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Author SHA1 Message Date
796176b4b4 Merge pull request 'issue/edgesVolume' (#59) from issue/edgesVolume into development
Reviewed-on: https://plasmalab.aero.upm.es/git/git/JGonzalez/fpakc/pulls/59
2026-02-26 19:21:52 +01:00
7208b2e0da Merge remote-tracking branch 'origin/issue/Maxwellian' into issue/edgesVolume 2026-02-04 19:59:59 +01:00
23bba31005 Fixed an issue with the random Maxwellian subroutines 2026-02-04 13:52:24 +01:00
159f2e7620 Trying partial reflection 2026-02-03 10:15:12 +01:00
34b5bdbb52 Merge pull request 'Wrong surface in edges' (#58) from issue/edgesVolume into development
Reviewed-on: https://plasmalab.aero.upm.es/git/git/JGonzalez/fpakc/pulls/58
2026-02-02 14:34:47 +01:00
8d5cb6a516 Wrong surface in edges
Some edges were calculating the area surface incorrectly, which was leading to wrong densities.
2026-02-02 14:31:58 +01:00
4747673d0a Bones of boundary 2026-01-28 14:56:38 +01:00
6a901a0cac Merge pull request 'feature/meshText' (#57) from feature/meshText into development
Reviewed-on: https://plasmalab.aero.upm.es/git/git/JGonzalez/fpakc/pulls/57
2026-01-23 15:27:27 +01:00
56a17300f3 Change in manual 2026-01-23 15:26:23 +01:00
0c0017b84a txs auto checkin 2026-01-23 15:21:26 +01:00
1b1a574edc Read initial
Now we can read an initial condition as we do with other formats.

Only documentation left.
2026-01-23 15:04:39 +01:00
d34e72d2e8 Collisions done
Thanks to the advance statement the output of collisions is done.
2026-01-23 14:51:49 +01:00
46b9f263ea Average done
Now we can output averages in this format.
2026-01-23 14:26:39 +01:00
8c8c6409f6 Output for EM
The output for the EM field properties is done.
2026-01-23 12:16:52 +01:00
27158c7c1d Output for species
First output done. Now it is mostly Copy Paste.

There are so many things I need to reform in other parts... Learning new things is awful.
2026-01-22 18:44:25 +01:00
3083e20ff7 Subroutine for reading mesh
It is now complete and working. I also added some minor improvements to moduleMesh.f90 using 'associate' to practice.

I noticed there are a lot of things (allocating K, for example) that are common for all meshes and should be moved to a general module.
2026-01-22 14:06:20 +01:00
7d4f4b98c3 Implementing input subroutines 2026-01-19 15:37:31 +01:00
9f9bacca7c Skeleton implementation of text mesh for simple 1D cases. 2026-01-19 14:48:06 +01:00
d5bcf8ce50 Merge branch 'issue/triangles' into 'development'
Fixed issue with volume in triangles

See merge request JorgeGonz/fpakc!56
2025-10-11 12:01:28 +00:00
55e062a9ef Fixed issue with volume in triangles
The right value in 2D Cartesian is used for calculating the volume.
2025-10-11 14:00:16 +02:00
c9b551458d Merge branch 'citationFile' into 'development'
Add citation file

See merge request JorgeGonz/fpakc!55
2025-09-24 17:34:24 +00:00
9d789ef7a6 Add citation file
I think it follows the standard.
2025-09-24 19:33:25 +02:00
b1f21a2c02 Merge branch 'IEPC2025' into 'development'
Merge IEPC2025

See merge request JorgeGonz/fpakc!54
2025-09-23 16:42:04 +00:00
dff9a87f0d Implemenint injecting particles without direction
I was almost sure this was implemented in the past, but it was not working.

Now, if n = 0 or if n is not provided, particles are injected with the normal to the surface.
2025-08-08 19:27:27 +02:00
5166a650d2 Data for Kr, just to test 2025-08-06 10:59:03 +02:00
3d7b1ce476 Fixed!
So it seems that rectangles and triangles are now working properly.

I have also checked the phy2log routine, now it seems a bit more complicated, but it is much clearer.
Maybe in the future is worth rethinking to improve speed (specially for quad elements)
2025-08-03 22:14:19 +02:00
102fd013f3 Issue with triangles fixed
Now they give the right electric field.

I have to change 2DCyl.

However, there was some insonsistency between the change of coordinates in phy2log and the Jacobian for the K matrix. I fixed it putting a transpose() in phy2log, but I don't like that solution.

I need to review the basic procedure of phy2log.
2025-08-03 20:46:12 +02:00
7e193b9fa8 Minor changes, no improvement made yet 2025-08-03 15:32:55 +02:00
d86c8480f3 Fixed issue with some velocities. Still, at some point I need to rething all the injection thing. 2025-08-02 16:51:00 +02:00
4b040c35c3 Fixes to random variables
After reading some works and reviewing what I had, I've done some
corrections to how the randomb velicities in Maxwellian distributions
are calculated. These should be correct now.
2025-08-02 13:25:48 +02:00
78cb9a2453 No reflection of particles at injection, that should be a boundary condition 2025-08-02 10:31:06 +02:00
d1e73297eb Adjust flux when no particlesPerEdge is used
This does not affects the cases of the IEPC, but I am also doing other
stuff.
2025-07-27 18:17:01 +02:00
8e531ede08 Vol_ref was the right answer 2025-07-27 17:16:57 +02:00
76c5af89b2 Merge branch 'IEPC2025' of gitlab.com:JorgeGonz/fpakc into IEPC2025 2025-07-27 17:15:36 +02:00
7f73b69dc2 Fix injection
Half-Maxwellian distribution should inject particles correctly
2025-07-27 17:14:38 +02:00
69215ef66d Change in calculating ionization
I don't know why I normalizing density n_0 by Vol_ref and not n_ref
2025-07-22 19:52:39 +02:00
a2f9957f32 I am dumb
The Poisson equation was not working because I didn't finish
implementing the new type of BCs. Dirichlet is probably untested. I
should stop doing shitty developments and no testing.
2025-07-18 16:31:52 +02:00
d28dd16c2e Average fix and data for Xe 2025-07-17 18:34:11 +02:00
221de46734 Merge branch 'development' into feature/BoltzmannElectrons 2024-10-13 14:54:34 +02:00
2268a97e23 Merge branch 'mergeDevleopment' into 'development'
Issue with injecting current

See merge request JorgeGonz/fpakc!53
2024-10-13 12:41:03 +00:00
3d8d912722 Merge branch 'development' of gitlab.com:JorgeGonz/fpakc into development 2024-10-13 13:35:34 +02:00
2af10acd70 Issue with injecting current
Values were not right in 1D geometry. Fixed.
2024-10-13 13:32:57 +02:00
98ee3e9c9c Still not working, but will be fixed
I have the solution in the plasma expansion code, but I need to do other
stuff.
2024-09-30 17:06:25 +02:00
0679fa58bc Merge branch 'feature/temporalDirichlet' into 'development'
Time variable Dirichlet condition

See merge request JorgeGonz/fpakc!52
2024-07-13 11:01:10 +00:00
6f185c4188 Organizing things
Move the array of pointers to the nodes to moduleMesh.
2024-07-13 12:35:42 +02:00
e4dfba45f8 Manual updated
New dirichletTime condition is documented.
2024-07-13 12:13:39 +02:00
2d4b405fb1 Functionality added
Now we have a new boundary condition that can change the value of the
potential in a surface based on a file.
2024-07-13 12:06:41 +02:00
10dee05922 NOT WORKING: Compilation okay, but not Dirichlet BC
The code compiles but the right BC is not being applied to the vectorF.

I'll check this tomorrow.
2024-07-12 23:30:35 +02:00
ac27725940 Big one...
I should've commited before, but I wanted to make things compile.

The big change is that I've added a global time step so the parameter
does not need to be passed in each function. This is useful as we are
moving towards using time profiles for boundary conditions and injection
of particles (not in this branch, but in the future and the procedure
will be quite similar)
2024-07-12 23:08:19 +02:00
49025a6965 Starting changes
Planning the new way to do BC in the EM field solver.
Probably I have to change how things are read, but I don't think this is
going to affect the input file.
2024-07-12 19:21:00 +02:00
f0a27c0529 More comments
So if the source vector is being updated every time step, it might be
"easy" to implement these things.
2024-07-12 13:17:02 +02:00
abedb79b16 Some comments
Just some comments on how I am going to make the desired changes (have a
Dirichlet boundary condition for the electric potential that changes
with time). This might be a good opportunity to rework the boundary
conditions in the electrostatic field and include other things like a
Newmann boundary condition. We will see.
2024-07-12 11:02:26 +02:00
065bb1d13e Merge branch 'issue/injection2DCyl' into 'development'
Rework of injection of particles with a special focus in 2DCyl to ensure an homogeneous distribution.

See merge request JorgeGonz/fpakc!51
2024-07-11 16:51:42 +00:00
fb9d1ad837 Update moduleMesh2DCyl.f90
This is not needed.
2024-07-11 16:44:29 +00:00
152ae6b097 No longer needed
The correction in the node volume is no longer needed as now things are
being calculated right with the last change.

Still, at some point I should review the calculation of the node volume
in 2DCyl.
2024-07-11 18:19:26 +02:00
72dd3c9073 I think I have it
So the radius for the volume integral in the nodes has to be set with a
1/4 3/4 ratio to match the change in volume as the radius changes along
the volume.

This has a bigger impact close to the edge.

Still unsure if this is the "right" thing to do, but at least it works
okay (it seems).
2024-07-11 17:40:57 +02:00
bc8f205287 Clean-up!
Trying to reduce warnings and unused variables in the code. This should
not be in this branch.
2024-07-11 15:55:02 +02:00
d710cc5e66 Probes fixed!
This should've been commited in another branch, but I am taking
advantage of this to clean up the code a bit.
2024-07-11 15:52:13 +02:00
03f3b81811 Manual updated
The manual has been modified to account for the new particlePerEdge
option and to indicate that now when the flux is giving by a flux like
in the Am2 units, the real surface of the inject is used to scale it.
2024-07-11 15:31:01 +02:00
6d62807fb4 Remove testing 'print' statements
2DCyl still seems to have some problems but waiting for simulation.
2024-07-11 14:50:14 +02:00
96c563c146 Finally, some progress
I rewrote how particles are injected. Now the particles per edge and its
weight are calculated in the initialization. There is the possibility
for the user to select the particles per edge.

TODO: Write documentation for new feature.
TODO: Test in 2DCyl
2024-07-11 14:39:56 +02:00
e23fc2fc2c Small progress
I made some small changes to how things are calculated.

I have also discovered that the issue with different density when
changing injection is not related with the node volume but with the way
injection is carried out. When loading particles from a file, all
provide the same density regardless the cell (node) volume.

I am doing testing in 2DCart as it is easier to set up.
2024-07-11 11:21:38 +02:00
9d961bb85f Removing weight from edges
This parameter is no longer needed.

Also removing the cumulative sum of weights from the injection.
2024-07-10 21:57:22 +02:00
cb92462f36 New injection based on surface to all geometries.
WARNING: 3DCart still not working (too tired to calculate things and I'm
    not ussing it...)
2024-07-10 21:55:45 +02:00
d608639e77 Forgot to save
Sorry.
2024-07-09 22:05:16 +02:00
667a2ecd93 So, no idea...
Basically things do not work. I've added a correction to the node volume
in the axis which gives okays results but still this is not perfect. I
need to find a better way to do things.

Also, I've noticed that the density changes with the size of the cells,
which should not happen! I'vw to check this issue.
2024-07-09 21:57:32 +02:00
11831a973d Still not working
Trying to have a very simple volume per node assuming a rectangle and
the density at the axis it higher than it should (kinda like when using
the more accurate volume calculation).

This is still weird. I also suspect that the size of the first cell in
the axis will also affect this...
2024-07-09 21:25:30 +02:00
b36f9c2615 Shifting towards constant number of particles per edge
So now each edge has the same number of particles and the weight of each
particle is calculated based on the surface of each edge compared to the
total one.

Only in 2DCyl, still to extend to other geometries.

Not perfect constant density, but the issue might be the node volume.
2024-07-09 17:49:42 +02:00
fa23f9481a Issue with bibliography
Backup files are properly ignored now.
2024-07-07 14:40:26 +02:00
1f2ec8d82f New option for initial distribution of species
The number of particles per cell can be defined when giving an initial
distribution fora species. If not, the typical method of using the
species weight is used. This is particularly useful for cylindrical
coordinates in which very little particles might end up in the axis if a
constant weight is used.
2024-07-07 14:37:34 +02:00
5bc064d018 Some parallel issues
Forgot to check Gmsh2 format with new changes.

Cartesian coordinates were not calculating things properly.
2024-07-07 11:53:56 +02:00
626e970d82 Some progress
Fixed an issue with random integer numbers.
Cylindrical coordinates are not perfect yet:
  - Box (cylinder) with initial constant density loses particles at r =
    0
  - Injection density still low in r = 0
2024-07-06 19:14:44 +02:00
6b5ac16e4b Still working on it
No uniform density yet...
2024-07-06 10:12:03 +02:00
b972120ed5 Switching to variable particle weight
I have to change the injection of particles. Each edge will receive a
similar number of particles and their weight will change to have a
constant density based on the geometry.

Still testing.
2024-07-04 10:56:13 +02:00
6b78ae3738 Added an adhoc factor to correct injection
I think that the volume of the nodes is not being well calculated, maybe
we need a better volume calculation for this, using multiple points (as
it is done for K)
2024-07-03 22:04:28 +02:00
0471517526 Merge branch 'issue/injection' into 'development'
Change in injection to achieve uniform density of particles.

See merge request JorgeGonz/fpakc!50
2024-06-30 08:50:25 +00:00
e277fe6ddb PI is no needed here 2024-06-30 08:48:51 +00:00
59a322a4c7 Clean up
Fixing calculation of node volumes.
2024-06-30 10:46:05 +02:00
cd7bf66bd8 A workaround
The random position for edges in the axis is corrected so that there is
a more uniform charge density in the axis.

Still, things are not perfect and this is something to really look into
in the future.
2024-06-30 10:36:36 +02:00
4cadfe5367 Seems are a bit better
There is still less density in the axis. I don't find a reason why.
There must be a modification to the weight...
2024-06-29 22:22:10 +02:00
5386114d15 Cylindrical injection working better
Seems things are a bit better. Still, more cases are needed and still
not perfectly uniform...
2024-06-29 14:58:48 +02:00
6389c8ba2d Quick because food
Cartesian fixed now
2024-06-27 12:08:08 +02:00
0ce921a48c Merge branch 'issue/quadLocation' into 'development'
Issue with calculating coordinates in quads

See merge request JorgeGonz/fpakc!49
2024-06-26 13:14:22 +00:00
c6470819e8 Issue with calculating coordinates in quads
The third coordinate (unused) was causing some errors when it was
becomming too large.
2024-06-26 15:11:01 +02:00
e4f7987f90 Trying to solve
Still I don't understand this basic thing...
2024-05-19 16:45:03 +02:00
a3bdf8230a Implementation of Boltzmann electrons
Still not working, just saving code.
2024-05-19 10:55:20 +02:00
62b8873786 Merge branch 'feature/Amps_per_m2' into 'development'
Implementing injection with current density

See merge request JorgeGonz/fpakc!48
2024-03-29 12:09:30 +00:00
d86b3a3417 Implementing injection with current density
WARNING: This current denstiy will be multiplied by the reference
length, no the surface area that is being used for injection!

New units in the injection of particles 'Am2' to inject a density
current. Manual has been modified accordingly.

Reference parameters are now also printed in the case folder.
2024-03-28 09:45:46 +01:00
a3d7b38e3b Merge branch 'improve/secondaryElectronIonization' into 'development'
Improve ionization

See merge request JorgeGonz/fpakc!47
2023-11-24 09:34:30 +00:00
e41b448ef8 Different species for secondary electrons
The option to have a different species than the impacting electron for
secondary electrons from ionization is introduced.
2023-11-24 10:30:50 +01:00
4585390b50 Fixing issue
Fixing an issue with reading tables led me to other issues with
collisions that I think are fixed right now. I am testing with the 1D
ionization model for ALPHIE and things seems to be working properly.
2023-11-21 09:53:36 +01:00
41 changed files with 1833 additions and 1528 deletions

50
CITATION.cff Normal file
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@ -0,0 +1,50 @@
# This CITATION.cff file was generated with cffinit.
# Visit https://bit.ly/cffinit to generate yours today!
cff-version: 1.2.0
title: Finite element Particle Kinetic Code
message: >-
If you use this software, please cite it using the
metadata from this file.
type: software
authors:
- given-names: Jorge
family-names: Gonzalez
email: jorge.gonzalez@upm.es
affiliation: Universidad Politécnica de Madrid
orcid: 'https://orcid.org/0000-0001-7905-5001'
repository-code: 'https://gitlab.com/JorgeGonz/fpakc'
abstract: >-
Welcome to fpakc (Finite element PArticle Kinetic Code), a
modern object oriented Fortran open-source code for
particle simulations of plasma and gases. This code works
by simulating charged and neutral particles, following
their trajectories, collisions and boundary conditions
imposed by the user.
One of our aims is to make a code easy to maintain as well
as easy to use by a variety of reserchers and students.
This code is currenlty in very early steps of development.
The code aims to be easy to maintain and easy to use,
allowing its application from complex problems to easy
examples that can be used, for example, as teaching
exercises.
Parallelization techniques such as OpenMP, MPI will be
used to distribute the cpu load. We aim to make fpakc GPU
compatible in the future.
The codefpakc makes use of finite elements to generate
meshes in complex geometries. Particle properties are
deposited in the nodes and cells of the mesh. The
electromagnetic field, with the boundary conditions
imposed by the user, is solved also in this mesh.
keywords:
- particle-in-cell
- plasma
- finite elements
license: GPL-3.0
version: beta
date-released: '2025-10-01'

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@ -0,0 +1,52 @@
# D108525 "refs": {"B56": {"note": "CLM-R294 (1989)"}}
# Relative energy (eV) cross section (m^2)
1.40E+01 0
1.62E+01 7.249E-21
1.88E+01 1.199E-20
2.18E+01 1.644E-20
2.53E+01 2.1E-20
2.94E+01 2.542E-20
3.41E+01 2.937E-20
3.95E+01 3.26E-20
4.58E+01 3.499E-20
5.32E+01 3.653E-20
6.17E+01 3.726E-20
7.15E+01 3.728E-20
8.29E+01 3.671E-20
9.62E+01 3.566E-20
1.12E+02 3.426E-20
1.29E+02 3.259E-20
1.50E+02 3.075E-20
1.74E+02 2.881E-20
2.02E+02 2.682E-20
2.34E+02 2.484E-20
2.72E+02 2.289E-20
3.15E+02 2.101E-20
3.65E+02 1.922E-20
4.24E+02 1.751E-20
4.91E+02 1.592E-20
5.70E+02 1.443E-20
6.61E+02 1.305E-20
7.67E+02 1.177E-20
8.89E+02 1.06E-20
1.03E+03 9.526E-21
1.20E+03 8.547E-21
1.39E+03 7.658E-21
1.61E+03 6.851E-21
1.87E+03 6.121E-21
2.16E+03 5.462E-21
2.51E+03 4.868E-21
2.91E+03 4.334E-21
3.38E+03 3.855E-21
3.92E+03 3.426E-21
4.54E+03 3.041E-21
5.27E+03 2.698E-21
6.11E+03 2.391E-21
7.09E+03 2.118E-21
8.22E+03 1.875E-21
9.53E+03 1.658E-21
1.11E+04 1.466E-21
1.28E+04 1.295E-21
1.49E+04 1.143E-21
1.72E+04 1.009E-21
2.00E+04 8.898E-22

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@ -0,0 +1,52 @@
# EL cross sections extracted from PROGRAM MAGBOLTZ, VERSION 7.1 JUNE 2004 www.lxcat.net/Biagi-v7.1
# Relative energy (eV) cross section (m^2)
1.21E+01 0
1.41E+01 3.923E-21
1.64E+01 1.194E-20
1.91E+01 2.1E-20
2.22E+01 2.946E-20
2.58E+01 3.65E-20
3.00E+01 4.185E-20
3.49E+01 4.552E-20
4.06E+01 4.766E-20
4.72E+01 4.85E-20
5.49E+01 4.828E-20
6.39E+01 5.031E-20
7.43E+01 5.1E-20
8.64E+01 5.1E-20
1.01E+02 5.032E-20
1.17E+02 4.906E-20
1.36E+02 4.732E-20
1.58E+02 4.521E-20
1.84E+02 4.283E-20
2.14E+02 4.029E-20
2.49E+02 3.764E-20
2.90E+02 3.497E-20
3.37E+02 3.233E-20
3.92E+02 2.975E-20
4.56E+02 2.726E-20
5.31E+02 2.489E-20
6.17E+02 2.266E-20
7.18E+02 2.056E-20
8.35E+02 1.861E-20
9.72E+02 1.68E-20
1.13E+03 1.514E-20
1.32E+03 1.361E-20
1.53E+03 1.221E-20
1.78E+03 1.094E-20
2.07E+03 9.781E-21
2.41E+03 8.735E-21
2.80E+03 7.789E-21
3.26E+03 6.938E-21
3.79E+03 6.171E-21
4.41E+03 5.484E-21
5.13E+03 4.868E-21
5.97E+03 4.316E-21
6.94E+03 3.824E-21
8.07E+03 3.385E-21
9.39E+03 2.994E-21
1.09E+04 2.646E-21
1.27E+04 2.336E-21
1.48E+04 2.062E-21
1.72E+04 1.818E-21
2.00E+04 1.602E-21

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bibliography.bib.bak
bibliography.bib.sav
*.bbl
*.blg
*.out

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34.297 74.332 34.297 75.082 c 34.297 75.832 34.398 76.578 34.609 77.316
c 34.828 78.059 35.148 78.793 35.578 79.535 c 34.797 79.535 l 34.316 78.773
33.953 78.027 33.703 77.285 c 33.461 76.547 33.344 75.813 33.344 75.082
c 33.344 74.355 33.461 73.625 33.703 72.895 c 33.941 72.156 34.305 71.402
34.797 70.629 c h
35.578 70.629 m f
41.875 72.754 m 39.906 75.41 l 41.984 78.223 l 40.922 78.223 l 39.328 76.066
l 37.734 78.223 l 36.672 78.223 l 38.797 75.363 l 36.859 72.754 l 37.922
72.754 l 39.375 74.707 l 40.813 72.754 l h
41.875 72.754 m f
43.121 79.676 m 44.168 79.676 l 44.168 76.066 l 43.027 76.301 l 43.027
75.707 l 44.152 75.488 l 44.793 75.488 l 44.793 79.676 l 45.84 79.676 l
45.84 80.223 l 43.121 80.223 l h
43.121 79.676 m f
47.621 76.988 m 48.652 76.988 l 48.652 77.816 l 47.855 79.379 l 47.215
79.379 l 47.621 77.816 l h
47.621 76.988 m f
55.117 72.754 m 53.148 75.41 l 55.227 78.223 l 54.164 78.223 l 52.57 76.066
l 50.977 78.223 l 49.914 78.223 l 52.039 75.363 l 50.102 72.754 l 51.164
72.754 l 52.617 74.707 l 54.055 72.754 l h
55.117 72.754 m f
56.801 79.676 m 59.035 79.676 l 59.035 80.223 l 56.02 80.223 l 56.02 79.676
l 56.27 79.426 56.602 79.094 57.02 78.676 c 57.434 78.25 57.699 77.973
57.816 77.848 c 58.023 77.621 58.164 77.426 58.238 77.27 c 58.32 77.105
58.363 76.941 58.363 76.785 c 58.363 76.535 58.273 76.332 58.098 76.176
c 57.918 76.02 57.691 75.941 57.41 75.941 c 57.211 75.941 56.996 75.98 56.77
76.051 c 56.551 76.113 56.316 76.219 56.066 76.363 c 56.066 75.707 l 56.316
75.605 56.551 75.527 56.77 75.473 c 56.996 75.422 57.207 75.395 57.395
75.395 c 57.883 75.395 58.273 75.52 58.566 75.77 c 58.855 76.012 59.004
76.34 59.004 76.754 c 59.004 76.941 58.965 77.125 58.895 77.301 c 58.82
77.48 58.691 77.688 58.504 77.926 c 58.449 77.988 58.277 78.168 57.988 78.457
c 57.707 78.75 57.309 79.156 56.801 79.676 c h
56.801 79.676 m f
60.484 70.629 m 61.266 70.629 l 61.754 71.402 62.117 72.156 62.359 72.895
c 62.609 73.625 62.734 74.355 62.734 75.082 c 62.734 75.813 62.609 76.547
62.359 77.285 c 62.117 78.027 61.754 78.773 61.266 79.535 c 60.484 79.535
l 60.922 78.793 61.242 78.059 61.453 77.316 c 61.672 76.578 61.781 75.832
61.781 75.082 c 61.781 74.332 61.672 73.594 61.453 72.863 c 61.242 72.125
60.922 71.379 60.484 70.629 c h
60.484 70.629 m f
Q Q
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end
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@ -1,5 +1,5 @@
\documentclass[10pt,a4paper,twoside]{book}
\usepackage[latin1]{inputenc}
%\usepackage[latin1]{inputenc}
\usepackage{amsmath}
\usepackage{amsfonts}
\usepackage{amssymb}
@ -72,7 +72,7 @@
The \Gls{fpakc} is a simulation tool that models species in plasma (ions, electrons and neutrals) following the trajectories of macro-particles as they move and interact between them and the boundaries of the domain.
Particles properties are scattered into a finite element mesh in 1, 2 or three dimensions, with the possibility to choose different geometries.
The official repository can be found at: \url{https://gitlab.com/JorgeGonz/fpakc.git}.
The code is currently in very early steps of development and further improvements are expected very soon.
The code is currently in the very early steps of development and further refinements are expected very soon.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\section{Main Guidelines}
@ -86,11 +86,11 @@
\item \acrshort{fpakc} is coded in a \textit{understandable} way.
This means that the code is required to be written in a clear way that is easy to understand and maintain.
Variables and procedure names need to be self-understanding.
This ease the process of fixing bugs and improving the codes by a large team of developers.
This eases the process of fixing bugs and improving the codes by a large team of developers.
For more information, please refer to the \acrshort{fpakc} Coding Style document.
\item \acrshort{fpakc} requires to be ease to use.
\item \acrshort{fpakc} requires being ease to use.
Input files are required to be in a \textit{human} format, meaning that the different options can be easily understood without constant reference to the user guide.
\acrshort{fpakc} is aimed to be used in a wide range of applications and by a variety of scientist: from very established ones to newcomers to the field and also students.
\acrshort{fpakc} is aimed to be used in a wide range of applications and by various scientists: from well-established ones to newcomers to the field and also students.
\end{enumerate}
These are foundation stones of \acrshort{fpakc} and its development and should always be followed, at least for the releases in the official repository.
@ -105,16 +105,16 @@
\section{The Particle Method}
\Gls{fpakc} uses macro-particles to simulate the dynamics of different plasma species (mainly ions, electrons and neutrals).
These macro-particles could represent a large amount of real particles.
For now own, macro-particles will be referred as just particles by abusing of language.
For now own, macro-particles will be referred as just particles by abuse of language.
During the initiation phase, the input and mesh file(s) are reading.
If an initial distribution for a species is specified in the input file, particles to match that distribution are loaded into the cells.
The general steps performed in each iteration are:
\begin{enumerate}
\item Firstly, new particles are introduced into the domain as specified in the input file.
\item Particles are then pushed accounting for possible acceleration by external forces.
During this process, if a particle changes cell it is found using the connectivity between elements.
If a particle encounters a boundary instead a new cell, the interaction between the boundary and the wall is computed.
\item Particles are then pushed, accounting for possible acceleration by external forces.
During this process, if a particle changes cell, it is found using the connectivity between elements.
If a particle encounters a boundary instead a new cell, the interaction between the boundary and the wall are computed.
A particle may abandon the computational domain and is no longer accounted for.
\item Next, collisions for the particles inside each cell are carried out.
This may include different collision processes for each particle.
@ -124,10 +124,10 @@
\item Finally, particle properties are scattered among the mesh nodes.
These properties are density, momentum and the stress tensor.
\item If requested, the electromagnetic field is computed.
\item If the number of iteration requires writing output files, it is done after all steps for the particles is completed.
\item If the number of iteration requires writing output files, it is done after all steps for the particles are completed.
\end{enumerate}
\Gls{fpakc} has the capability to configure all the behavior of the simulation via the input file.
\Gls{fpakc} has the capability to configure all the behaviour of the simulation via the input file.
Parameters as injection, the kind of pusher used for each species, boundary conditions or collisions are user-input parameters and will be described in Chap.~\ref{ch:input_file}.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
@ -168,8 +168,8 @@
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\section{Find new cell}
Once the position and velocity of the particle are updated, the new cell that contains the particle is searched.
This is done by a neighbor search, starting from the previous cell containing the particle.
In the process of finding the new cell, it is possible that a particle encounters a boundary.
This is done by a neighbour search, starting from the previous cell containing the particle.
In the process of finding the new cell, a particle might encounter a boundary.
When the particle interacts with the boundary, the particle may continue its life in the simulation or might be eliminated from it.
Once that the new cell is found or that the particle life has been terminated, the pushing is complete.
If a secondary mesh is used for the Monte-Carlo Collision method, the new cell in that mesh in which the particle reside is also found by the same method, although no interaction with the boundaries is accounted for this step.
@ -178,7 +178,7 @@
\section{Variable Weighting Scheme\label{sec:weightingScheme}}
One of the issues in particle simulations, specially for axial-symmetrical cases, is that due to the disparate volume of cells, specially close to the axis, the statistics in some cells is usually poor.
To try to fix that, the possibility to include a Variable Weighting Scheme in the simulations is available in \Gls{fpakc}.
These schemes detect when a particle change cells and split it if necessary to improve statistics.
These schemes detect when a particle changes cells and split it if necessary to improve statistics.
The use of a Variable Weighting Scheme is defined by the user in the input file.
Beware that this can increase the number of particles in the simulation and increase computational time.
@ -189,16 +189,16 @@
\Gls{fpakc} distinguish between two types of interactions: \acrfull{mcc} and \acrfull{cs}.
\acrshort{mcc} refers to the process in which two particles interact in short range.
These processes include, but are not limited to: elastic collisions, ionization/recombination, charge-exchange, excitation/de-excitation\ldots
A secondary mesh, with cell sizes in the range of the mean-free path, can be used for this type of collisions.
A secondary mesh, with cell sizes in the range of the mean-free path, can be used for this type of collision.
\acrshort{cs} refers to the large range interaction that a charged species suffer do to the charge of other particles.
The interactions between the different species is defined by the user.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\subsection{\acrlong{mcc}}
For each cell the maximum number of collisions between particle is computed.
For each cell, the maximum number of collisions between particle is computed.
For each collision, a random pair of particles is chosen.
A loop over all possible collisions for the pair of particles chosen is performed.
If a random number is above the probability of collision for that specific type, the collision take place.
If a random number is above the probability of collision for that specific type, the collision takes place.
If not, the next type for the particle pair is checked.
Below are described the type of collision process implemented in \acrshort{fpakc}:
@ -219,7 +219,7 @@
\item Recombination.
When an electron and an ion interact, there is a possibility for them to be recombined into a neutral particle.
The photon emitted by this process is not modelled yet.
The photons emitted by this process are not modelled yet.
\end{itemize}
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
@ -238,7 +238,7 @@
Once that the pushing is complete, the array of particles that remain inside the domain is copied to a new array.
The new array containing only the particles inside the domain will be the one used in the next steps.
In this section, particles are assigned to the list of particles inside each individual cell.
Unfortunately, this is done right now without parallelisation and is very CPU consuming.
Unfortunately, this is done right now without parallelization and is very CPU consuming.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\section{Probing}\label{sec:probing}
@ -250,21 +250,21 @@
The user can decide the grid width and the number of points in each direction.
The distribution function will be calculated and wrote with a time step decided by the user.
If a particle velocity resides outside of the velocity grid (in any direction), it wont be added to the tally of the distribution function.
Due to the limitation of only taking into account particles in the cell, and not neighbour particles, two probes for the same species at different positions but in the same cell will output the same results.
A more advance method taking into account distance between the particles and the probe position as well as particles in neighbour cells could be implemented to improve the statistics of the distribution function.
If a particle velocity resides outside the velocity grid (in any direction), it will not be added to the tally of the distribution function.
Due to the limitation of only considering particles in the cell, and not neighbour particles, two probes for the same species at different positions but in the same cell will output the same results.
A more advance method considering distance between the particles and the probe position as well as particles in neighbour cells could be implemented to improve the statistics of the distribution function.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\section{Scattering}
The properties of each particle are deposited in the nodes from the containing cell.
This process depend on the cell type, but in general, each node receive a proportional part of the particle properties as a function of the particle position inside the cell.
Figure \ref{fig:scatteringQuad} shows how a particle at a generic position $p(x_1, x_2)$ inside the cell is scattered to the four nodes.
This process depends on the cell type, but in general, each node receives a proportional part of the particle properties as a function of the particle position inside the cell.
The figure \ref{fig:scatteringQuad} shows how a particle at a generic position $p(x_1, x_2)$ inside the cell is scattered to the four nodes.
\begin{wrapfigure}{l}{0.4\textwidth}
\centering
\includegraphics{figures/scatteringQuad}
\caption{\label{fig:scatteringQuad}Example of how a particle is weighted in a quadrilateral cell.}
\end{wrapfigure}
Each node receives a proportional part of the area formed by dividing the cell in for rectangles using as an additional vertex the particle position.
Each node receives a proportional part of the area formed by dividing the cell in for rectangles, using as an additional vertex the particle position.
These properties are dimensionless, but they are converted to the correct units once the output is printed.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
@ -273,11 +273,11 @@
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\section{Average scheme}
Particle-in-cell codes has an intrinsic statistical noise associated with them.
Particle-in-cell codes have an intrinsic statistical noise associated with them.
Although this can be reduced by increasing the number of particles, this also increases the CPU requirements of the case.
It is quite common that most cases reach a quasi-steady state after a number of iterations and time-average results can be obtained after to improve analysis, plotting and restarting the case using these time-average results as new species backgrounds.
Although this is possible to do once the simulation is finished with post-processing tools, this is limited to the amount of iterations printed.
Although this is possible to do once the simulation is finished with post-processing tools, this is limited to the number of iterations printed.
\Gls{fpakc} implements a simple average scheme that, after a start time provided by the user, scores a mean and standard deviation of all the main species properties, and the electromagnetic field.
This scheme is based on the Welford's online algorithm~\cite{welford1962note}.
@ -286,7 +286,7 @@
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\chapter{Installation}
\section{Required Packages}
In order to properly compile \gls{fpakc}, the following packages are required.
To properly compile \gls{fpakc}, the following packages are required.
\subsection{Gfortran}
The \Gls{opensource} free compiler \Gls{gfortran}\cite{gfortranURL} from GCC is the basic way to compile \acrshort{fpakc}.
It is distributed with all GNU/Linux distributions.
@ -369,7 +369,7 @@ make
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\section{Case file}
The required format for the case file is \Gls{json}.
\Gls{json} is a case-sensitive format, so input must be written with the correct capitalisation.
\Gls{json} is a case-sensitive format, so input must be written with the correct capitalization.
The basic structure and options available for the case file are explained below.
The order of the objects and variables is irrelevant, but the structure needs to be maintained.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
@ -380,9 +380,9 @@ make
\item \textbf{path}: Character.
Path for the output files. This path is also used to locate the mesh input file.
\item \textbf{folder}: Character.
Base name of the folder in wich output files are placed.
Base name of the folder in which output files are placed.
The date and time is appended to this name.
If none is provided, only the date and time is writted as the folder name.
If none is provided, only the date and time is written as the folder name.
\item \textbf{triggerOutput}: Integer.
Determines the number of iterations between writing output files for macroscopic quantities.
\item \textbf{cpuTime}: Logical.
@ -460,6 +460,10 @@ make
\begin{itemize}
\item \textbf{gmsh2}: \Gls{gmsh} file format in version 2.0. This has to be in ASCII format.
\item \textbf{vtu}: \Gls{vtu} file format. This has to be in ASCII format.
\item \textbf{text}: Plain text file format only intended for 1D cases.
This has to be in ASCII format and comma separated.
The first column represents the position and the second column the physical ID of the node.
Values have to be $1$ (left boundary), $2$ (right boundary), or $0$ (no boundary.)
\end{itemize}
\item \textbf{meshFile}: Character.
Mesh filename.
@ -515,7 +519,7 @@ make
\item \textbf{absorption}: Particle is eliminated from the domain.
The particle is first moved into the edge and its properties are scattered among the edge nodes.
\item \textbf{transparent}: Particle abandon the numerical domain.
\item \textbf{wallTemperature}: Reflective wall with cosntant temperature that exchange heat with particles.
\item \textbf{wallTemperature}: Reflective wall with constant temperature that exchange heat with particles.
Required parameters are:
\begin{itemize}
\item \textbf{temperature}: Real.
@ -526,8 +530,8 @@ make
Specific heat capacity of the material.
\end{itemize}
\item \textbf{ionization}: Per each particle crossing the surface with this type of boundary, a number of ionization events are calculated.
A pair of ion-electron is generated for each ionization event taking as a reference a neutral background.
Secondary electron is taken as same type as incident particle.
A pair of ion-electron is generated for each ionization event, taking as a reference a neutral background.
The secondary electron is taken as the same type as the incident particle.
The available input is:
\begin{itemize}
\item \textbf{neutral}: Object.
@ -540,7 +544,7 @@ make
\item \textbf{mass}: Real.
Units in $\unit{kg}$.
Mass of neutral species.
If missing, the mass of the ion is ussed
If missing, the mass of the ion is used
\item \textbf{density}: Real.
Units in $\unit{m^{-3}}$.
Density of neutral background.
@ -558,18 +562,18 @@ make
\end{itemize}
\item \textbf{effectiveTime}: Real.
Units in $\unit{s}$.
As the particle is no longer simulated once it crossed the boundary, this time represent the effective time in which the particle produces ionization processes in the neutral background.
As the particle is no longer simulated once it crossed the boundary, this time represents the effective time in which the particle produces ionization processes in the neutral background.
Required parameter.
\item \textbf{energyThreashold}: Real.
Units in $\unit{eV}$.
Ionization energy threshold for the simulated process.
Required parameter.
\item \textbf{crossSection}: Character.
Complete path to the cross section data for the ionization process.
Complete path to the cross-section data for the ionization process.
\end{itemize}
\item \textbf{axis}: Identifies the symmetry axis for 2D cylindrical simulations.
If for some reason a particle interact with this axis, it is reflected.
If , for some reason, a particle interacts with this axis, it is reflected.
\end{itemize}
\end{itemize}
@ -585,18 +589,26 @@ make
Type of boundary.
Accepted values are:
\begin{itemize}
\item \textbf{dirichlet}: Elastic reflection of particles.
\item \textbf{dirichlet}: Constant value of electric potential on the surface.
\item \textbf{dirichletTime}: Constant value of the electric potential with a time variable profile.
The value of \textbf{boundaryEM.potential} will be multiplied for the corresponding value in the file \textbf{boundaryEM.temporalProfile}.
\end{itemize}
\item \textbf{potential}: Real.
Fixed potential for Dirichlet boundary condition.
\item \textbf{physicalSurface}: Integer.
Identification of the edge in the mesh file.
\item \textbf{temporalProfile}: Character.
Filename of the 2 column file containing the time variable profile.
File must be located in \textbf{output.path}.
The first column is the time in $\unit{s}$.
The second column is the factor that will multiply the value of the boundary.
\end{itemize}
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\subsection{inject}
The array \textbf{inject} specifies the injection of particles from different surfaces.
The injection of particles need to be associated to a physicalSurface in the mesh file.
The injection of particles needs to be associated to a physicalSurface in the mesh file.
Multiple injections can be associated to the same surface.
\begin{itemize}
\item \textbf{name}: Character.
@ -610,7 +622,9 @@ make
Available values are:
\begin{itemize}
\item \textbf{A}: Ampere.
\item \textbf{sccm}: Standard cubic centimeter.
\item \textbf{Am2}: Ampere per square meter.
This value will be multiplied by the area of injection.
\item \textbf{sccm}: Standard cubic centimetre.
\item \textbf{part/s}: Particles (real) per second.
\end{itemize}
\item \textbf{v}: Real.
@ -627,7 +641,7 @@ make
\begin{itemize}
\item \textbf{Maxwellian}: Maxwellian distribution of temperature \textbf{T} and mean \textbf{v} times the value of \textbf{n} in the specified direction.
\item \textbf{Half-Maxwellian}: Half-Maxwellian distribution of temperature \textbf{T} and mean \textbf{v} times the value of \textbf{n} in the specified direction.
Only takes into account the positive part of the half-Maxwellian.
Only considers the positive part of the half-Maxwellian.
\item \textbf{Delta}: Dirac's delta distribution function. All particles are injected with velocity \textbf{v} times the value of \textbf{n} in the specified direction.
\end{itemize}
\item \textbf{T}: Real.
@ -636,6 +650,11 @@ make
Temperature in each direction.
\item \textbf{physicalSurface}: Integer.
Identification of the edge in the mesh file.
\item \textbf{particlesPerEdge}: Integer.
Optional.
Number of particles to be injected by each edge in the numerical domain.
The weight of the particles for each edge will modified by the surface of the edge to ensure the right flux is injected.
If no value is provided, the number of particles to inject per edge will be calculated with the species weight and the surface of the edge respect to the total one.
\end{itemize}
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\subsection{reference}
@ -651,7 +670,7 @@ make
\item \textbf{radius}: Real.
Reference atomic radius in $\unit{m}$.
\item \textbf{crossSection}: Real.
Reference cross section in $\unit{m^2}$.
Reference cross-section in $\unit{m^2}$.
If this value is present, radius is ignored.
\end{itemize}
@ -677,8 +696,8 @@ make
Indicates the type of pusher used for each species:
\begin{itemize}
\item \textbf{Neutral}: Pushes a particle without any external force.
\item \textbf{Electrostatic}: Pushes a particle including the effect of the electrostatic field.
\item \textbf{Electromagnetic}: Pushes particles accounting for the electromagnetic field.
\item \textbf{Electrostatic}: Pushes a particle, including the effect of the electrostatic field.
\item \textbf{Electromagnetic}: Pushes a particle, accounting for the electromagnetic field.
\end{itemize}
\item \textbf{WeightingScheme}: Character.
Indicates the variable weighting scheme to be used in the simulation.
@ -710,7 +729,11 @@ make
Output file from previous run used as an initial state for the species.
The file format must be the same as in \textbf{geometry.meshType}
Initial particles are assumed to have a Maxwellian distribution.
File must be located at \textbf{output.path}.
File must be located in \textbf{output.path}.
\item \textbf{particlesPerCell}: Integer.
Optional.
Initial number of particles per cell.
If not, the number of particles per cell will be assigned based on the species weight and the cell volume.
\end{itemize}
\end{itemize}
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
@ -726,11 +749,11 @@ make
\end{itemize}
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\subsection{interactions}\label{ssec:input_interactions}
This object determine the different interactions among species.
This object determines the different interactions among species.
Acceptable values are:
\begin{itemize}
\item \textbf{folderCollisions}: Character.
Indicates the path to in which the cross section tables are allocated.
Indicates the path to in which the cross-section tables are allocated.
\item \textbf{meshCollisions}: Character.
Determines a specific mesh for \acrshort{mcc} processes.
The file needs to be located in the folder \textbf{output.folder}.
@ -757,13 +780,18 @@ make
Accepted values are \textbf{elastic}, \textbf{chargeExchange}, \textbf{ionization} and \textbf{recombination}.
Please refer to Sec.~\ref{ssec:collisions} for a description of the different collision types.
\item \textbf{crossSection}: Character.
File in \textbf{interactions.folderCollisions} that contains the cross section data as a 1D table of relative energy (in $\unit{eV}$) and cross section (in $\unit{m^-2}$).
File in \textbf{interactions.folderCollisions} that contains the cross-section data as a 1D table of relative energy (in $\unit{eV}$) and cross-section (in $\unit{m^-2}$).
\item \textbf{energyThreshold}: Real.
Energy threshold of the collisional process in $\unit{eV}$.
Only valid for \textbf{ionization} and \textbf{recombination} processes.
\item \textbf{electron}: Character.
Name of species designed as electrons.
Only valid for \textbf{ionization} and \textbf{recombination} processes.
\item \textbf{electronSecondary}: Character.
Optional.
Name of species designed as secondary electrons.
If none provided, \textbf{electron} is used.
Only valid for \textbf{ionization}.
\end{itemize}
\end{itemize}
\item \textbf{Coulomb}: Array of objects.
@ -773,7 +801,7 @@ make
\begin{itemize}
\item \textbf{species\_i}, \textbf{species\_j}: Character.
Define the two species involved in the collision processes.
Order is indiferent.
Order is indifferent.
\end{itemize}
\end{itemize}
@ -799,9 +827,9 @@ make
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
\section{1D Emissive Cathode (1D\_Cathode)}
Emission from a 1D cathode in both, cartesian and radial coordinates.
Both cases insert the same amount of electrons from the minimum coordinate and have the same boundary conditions for particles and the electrostatic field.
This case is useful to ilustrate hoy \acrshort{fpakc} can deal with different geometries by just modifying some parameters in the input file.
Emission from a 1D cathode in both, Cartesian and radial coordinates.
Both cases insert the same number of electrons from the minimum coordinate and have the same boundary conditions for particles and the electrostatic field.
This case is useful to illustrate how \acrshort{fpakc} can deal with different geometries by just modifying some parameters in the input file.
The same mesh file (\lstinline|mesh.msh|) is used for both cases.
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%

View file

@ -11,12 +11,12 @@ PROGRAM fpakc
USE OMP_LIB
IMPLICIT NONE
! t = time step
INTEGER:: t
! arg1 = Input argument 1 (input file)
CHARACTER(200):: arg1
! inputFile = path+name of input file
CHARACTER(:), ALLOCATABLE:: inputFile
! generic integer for time step
INTEGER:: t
tStep = omp_get_wtime()
!Gets the input file
@ -27,11 +27,18 @@ PROGRAM fpakc
!Reads the json configuration file
CALL readConfig(inputFile)
!Create output folder and initial files
CALL initOutput(inputFile)
!Do '0' iteration
t = tInitial
timeStep = tInitial
!$OMP PARALLEL DEFAULT(SHARED)
!$OMP SINGLE
! Initial reset of probes
CALL resetProbes()
CALL verboseError("Initial scatter of particles...")
!$OMP END SINGLE
CALL doScatter()
@ -45,19 +52,21 @@ PROGRAM fpakc
tStep = omp_get_wtime() - tStep
!Output initial state
CALL doOutput(t)
CALL doOutput()
CALL verboseError('Starting main loop...')
!$OMP PARALLEL DEFAULT(SHARED)
DO t = tInitial + 1, tFinal
!Insert new particles and push them
!$OMP SINGLE
tStep = omp_get_wtime()
! Update global time step index
timeStep = t
!Checks if a species needs to me moved in this iteration
CALL solver%updatePushSpecies(t)
CALL solver%updatePushSpecies()
!Checks if probes need to be calculated this iteration
CALL resetProbes(t)
CALL resetProbes()
tPush = omp_get_wtime()
!$OMP END SINGLE
@ -75,7 +84,7 @@ PROGRAM fpakc
!$OMP END SINGLE
IF (doMCCollisions) THEN
CALL meshForMCC%doCollisions(t)
CALL meshForMCC%doCollisions()
END IF
@ -120,12 +129,12 @@ PROGRAM fpakc
!$OMP SINGLE
tEMField = omp_get_wtime() - tEMField
CALL doAverage(t)
CALL doAverage()
tStep = omp_get_wtime() - tStep
!Output data
CALL doOutput(t)
CALL doOutput()
!$OMP END SINGLE
END DO

View file

@ -9,6 +9,7 @@ OBJECTS = $(OBJDIR)/moduleMesh.o $(OBJDIR)/moduleMeshBoundary.o $(OBJDIR)/module
$(OBJDIR)/moduleMeshInputVTU.o $(OBJDIR)/moduleMeshOutputVTU.o \
$(OBJDIR)/moduleMeshInputGmsh2.o $(OBJDIR)/moduleMeshOutputGmsh2.o \
$(OBJDIR)/moduleMeshInput0D.o $(OBJDIR)/moduleMeshOutput0D.o \
$(OBJDIR)/moduleMeshInputText.o $(OBJDIR)/moduleMeshOutputText.o \
$(OBJDIR)/moduleMesh3DCart.o \
$(OBJDIR)/moduleMesh2DCyl.o \
$(OBJDIR)/moduleMesh2DCart.o \

View file

@ -2,8 +2,13 @@
MODULE moduleCaseParam
!Final and initial iterations
INTEGER:: tFinal, tInitial = 0
! Global index of current iteration
INTEGER:: timeStep
! Time step for all species
REAL(8), ALLOCATABLE:: tau(:)
! Minimum time step
REAL(8):: tauMin
! Time step for Monte-Carlo Collisions
REAL(8):: tauColl
END MODULE moduleCaseParam

View file

@ -40,31 +40,48 @@ MODULE moduleRandom
INTEGER:: rnd
REAL(8):: rnd01
rnd = 0.D0
rnd = 0
CALL RANDOM_NUMBER(rnd01)
rnd = INT(REAL(b - a) * rnd01) + 1
rnd = a + FLOOR((b+1-a)*rnd01)
END FUNCTION randomIntAB
!Returns a random number in a Maxwellian distribution of mean 0 and width 1 with the Box-Muller Method
function randomMaxwellian() result(rnd)
USE moduleConstParam, only: pi
implicit none
real(8):: rnd
real(8):: v1, v2, Rsquare
v1 = 0.d0
do while (v1 <= 0.d0)
v1 = random()
end do
v2 = random()
rnd = sqrt(-2.d0*log(v1))*cos(2*pi*v2)
end function randomMaxwellian
!Returns a random number in a Maxwellian distribution of mean 0 and width 1
FUNCTION randomMaxwellian() RESULT(rnd)
USE moduleConstParam, ONLY: PI
FUNCTION randomHalfMaxwellian() RESULT(rnd)
IMPLICIT NONE
REAL(8):: rnd
REAL(8):: x, y
REAL(8):: x
rnd = 0.D0
x = 0.D0
DO WHILE (x == 0.D0)
CALL RANDOM_NUMBER(x)
END DO
CALL RANDOM_NUMBER(y)
rnd = DSQRT(-2.D0*DLOG(x))*DCOS(2.D0*PI*y)
rnd = DSQRT(-DLOG(x))
END FUNCTION randomMaxwellian
END FUNCTION randomHalfMaxwellian
!Returns a random number weighted with the cumWeight array
FUNCTION randomWeighted(cumWeight, sumWeight) RESULT(rnd)
@ -73,10 +90,21 @@ MODULE moduleRandom
REAL(8), INTENT(in):: cumWeight(1:)
REAL(8), INTENT(in):: sumWeight
REAL(8):: rnd0b
INTEGER:: rnd
INTEGER:: rnd, i
rnd0b = random(0.D0, sumWeight)
rnd = MINLOC(DABS(rnd0b - cumWeight), 1)
rnd0b = random()
i = 1
DO
IF (rnd0b <= cumWeight(i)/sumWeight) THEN
rnd = i
EXIT
ELSE
i = i +1
END IF
END DO
! rnd = MINLOC(DABS(rnd0b - cumWeight), 1)
END FUNCTION randomWeighted

View file

@ -93,7 +93,7 @@ MODULE moduleTable
f = self%fMax
ELSE
i = MINLOC(x - self%x, 1)
i = MINLOC(ABS(x - self%x), 1)
deltaX = x - self%x(i)
IF (deltaX < 0 ) THEN
i = i - 1

View file

@ -84,20 +84,6 @@ MODULE moduleInput
CALL readParallel(config)
CALL checkStatus(config, "readParallel")
!If everything is correct, creates the output folder
CALL EXECUTE_COMMAND_LINE('mkdir ' // path // folder )
!Copies input file to output folder
CALL EXECUTE_COMMAND_LINE('cp ' // inputFile // ' ' // path // folder)
!Copies particle mesh
IF (mesh%dimen > 0) THEN
CALL EXECUTE_COMMAND_LINE('cp ' // pathMeshParticle // ' ' // path // folder)
IF (doubleMesh) THEN
CALL EXECUTE_COMMAND_LINE('cp ' // pathMeshColl // ' ' // path // folder)
END IF
END IF
END SUBROUTINE readConfig
!Checks the status of the JSON case file and, if failed, exits the execution.
@ -273,13 +259,17 @@ MODULE moduleInput
!Read BC
CALL readEMBoundary(config)
CASE("ElectrostaticBoltzmann")
!Read BC
CALL readEMBoundary(config)
CASE("ConstantB")
!Read BC
CALL readEMBoundary(config)
!Read constant magnetic field
DO i = 1, 3
WRITE(istring, '(i2)') i
CALL config%get(object // '.B(' // istring // ')', B(i), found)
WRITE(iString, '(i2)') i
CALL config%get(object // '.B(' // iString // ')', B(i), found)
IF (.NOT. found) THEN
CALL criticalError('Constant magnetic field not provided in direction ' // iString, 'readSolver')
@ -322,7 +312,7 @@ MODULE moduleInput
LOGICAL:: found
CHARACTER(:), ALLOCATABLE:: object
INTEGER:: nInitial
INTEGER:: i, j, p, e
INTEGER:: i, p, e
CHARACTER(LEN=2):: iString
CHARACTER(:), ALLOCATABLE:: spName
INTEGER:: sp
@ -338,7 +328,8 @@ MODULE moduleInput
REAL(8):: densityCen
!Mean velocity and temperature at particle position
REAL(8):: velocityXi(1:3), temperatureXi
INTEGER:: nNewPart = 0.D0
INTEGER:: nNewPart = 0
REAL(8):: weight = 0.D0
CLASS(meshCell), POINTER:: cell
TYPE(particle), POINTER:: partNew
REAL(8):: vTh
@ -357,6 +348,9 @@ MODULE moduleInput
!Reads node values at the nodes
filename = path // spFile
CALL mesh%readInitial(filename, density, velocity, temperature)
!Check if initial number of particles is given
CALL config%get(object // '.particlesPerCell', nNewPart, found)
!For each volume in the node, create corresponding particles
DO e = 1, mesh%numCells
!Scale variables
@ -369,7 +363,11 @@ MODULE moduleInput
densityCen = mesh%cells(e)%obj%gatherF((/ 0.D0, 0.D0, 0.D0 /), nNodes, sourceScalar)
!Calculate number of particles
nNewPart = INT(densityCen * (mesh%cells(e)%obj%volume*Vol_ref) / species(sp)%obj%weight)
IF (.NOT. found) THEN
nNewPart = FLOOR(densityCen * (mesh%cells(e)%obj%volume*Vol_ref) / species(sp)%obj%weight)
END IF
weight = densityCen * (mesh%cells(e)%obj%volume*Vol_ref) / REAL(nNewPart)
!Allocate new particles
DO p = 1, nNewPart
@ -406,7 +404,7 @@ MODULE moduleInput
partNew%n_in = .TRUE.
partNew%weight = species(sp)%obj%weight
partNew%weight = weight
!Assign particle to temporal list of particles
CALL partInitial%add(partNew)
@ -634,7 +632,7 @@ MODULE moduleInput
INTEGER:: i, k, ij
INTEGER:: pt_i, pt_j
REAL(8):: energyThreshold, energyBinding
CHARACTER(:), ALLOCATABLE:: electron
CHARACTER(:), ALLOCATABLE:: electron, electronSecondary
INTEGER:: e
CLASS(meshCell), POINTER:: cell
@ -711,9 +709,17 @@ MODULE moduleInput
IF (.NOT. found) CALL criticalError('energyThreshold not found for collision' // object, 'readInteractions')
CALL config%get(object // '.electron', electron, found)
IF (.NOT. found) CALL criticalError('electron not found for collision' // object, 'readInteractions')
CALL config%get(object // '.electronSecondary', electronSecondary, found)
IF (found) THEN
CALL initBinaryIonization(interactionMatrix(ij)%collisions(k)%obj, &
crossSecFilePath, energyThreshold, electron, electronSecondary)
ELSE
CALL initBinaryIonization(interactionMatrix(ij)%collisions(k)%obj, &
crossSecFilePath, energyThreshold, electron)
END IF
CASE ('recombination')
!Electorn impact ionization
CALL config%get(object // '.energyBinding', energyBinding, found)
@ -797,7 +803,7 @@ MODULE moduleInput
TYPE(json_file), INTENT(inout):: config
INTEGER:: i, s
CHARACTER(2):: istring, sString
CHARACTER(2):: iString, sString
CHARACTER(:), ALLOCATABLE:: object, bType
REAL(8):: Tw, cw !Wall temperature and specific heat
!Neutral Properties
@ -805,16 +811,16 @@ MODULE moduleInput
REAL(8), DIMENSION(:), ALLOCATABLE:: v0
REAL(8):: effTime
REAL(8):: eThreshold !Energy threshold
INTEGER:: speciesID
CHARACTER(:), ALLOCATABLE:: speciesName, crossSection
INTEGER:: speciesID, electronSecondaryID
CHARACTER(:), ALLOCATABLE:: speciesName, crossSection, electronSecondary
LOGICAL:: found
INTEGER:: nTypes
CALL config%info('boundary', found, n_children = nBoundary)
ALLOCATE(boundary(1:nBoundary))
DO i = 1, nBoundary
WRITE(istring, '(i2)') i
object = 'boundary(' // TRIM(istring) // ')'
WRITE(iString, '(i2)') i
object = 'boundary(' // TRIM(iString) // ')'
boundary(i)%n = i
CALL config%get(object // '.name', boundary(i)%name, found)
@ -823,18 +829,30 @@ MODULE moduleInput
IF (nTypes /= nSpecies) CALL criticalError('Not enough boundary types defined in ' // object, 'readBoundary')
ALLOCATE(boundary(i)%bTypes(1:nSpecies))
DO s = 1, nSpecies
associate(bound => boundary(i)%bTypes(s)%obj)
WRITE(sString,'(i2)') s
object = 'boundary(' // TRIM(iString) // ').bTypes(' // TRIM(sString) // ')'
CALL config%get(object // '.type', bType, found)
SELECT CASE(bType)
CASE('reflection')
ALLOCATE(boundaryReflection:: boundary(i)%bTypes(s)%obj)
ALLOCATE(boundaryReflection:: bound)
CASE('absorption')
ALLOCATE(boundaryAbsorption:: boundary(i)%bTypes(s)%obj)
ALLOCATE(boundaryAbsorption:: bound)
CASE('transparent')
ALLOCATE(boundaryTransparent:: boundary(i)%bTypes(s)%obj)
ALLOCATE(boundaryTransparent:: bound)
CASE('axis')
ALLOCATE(boundaryAxis:: bound)
CASE('wallTemperature')
CALL config%get(object // '.temperature', Tw, found)
IF (.NOT. found) CALL criticalError("temperature not found for wallTemperature boundary type", 'readBoundary')
CALL config%get(object // '.specificHeat', cw, found)
IF (.NOT. found) CALL criticalError("specificHeat not found for wallTemperature boundary type", 'readBoundary')
CALL initWallTemperature(bound, Tw, cw)
CASE('ionization')
!Neutral parameters
@ -861,25 +879,28 @@ MODULE moduleInput
CALL config%get(object // '.crossSection', crossSection, found)
IF (.NOT. found) CALL criticalError("missing parameter 'crossSection' for neutrals in ionization", 'readBoundary')
CALL initIonization(boundary(i)%bTypes(s)%obj, species(s)%obj%m, m0, n0, v0, T0, &
CALL config%get(object // '.electronSecondary', electronSecondary, found)
electronSecondaryID = speciesName2Index(electronSecondary)
IF (found) THEN
CALL initIonization(bound, species(s)%obj%m, m0, n0, v0, T0, &
speciesID, effTime, crossSection, eThreshold,electronSecondaryID)
ELSE
CALL initIonization(bound, species(s)%obj%m, m0, n0, v0, T0, &
speciesID, effTime, crossSection, eThreshold)
CASE('wallTemperature')
CALL config%get(object // '.temperature', Tw, found)
IF (.NOT. found) CALL criticalError("temperature not found for wallTemperature boundary type", 'readBoundary')
CALL config%get(object // '.specificHeat', cw, found)
IF (.NOT. found) CALL criticalError("specificHeat not found for wallTemperature boundary type", 'readBoundary')
END IF
CALL initWallTemperature(boundary(i)%bTypes(s)%obj, Tw, cw)
CASE('axis')
ALLOCATE(boundaryAxis:: boundary(i)%bTypes(s)%obj)
case('outflowAdaptive')
allocate(boundaryOutflowAdaptive:: bound)
CASE DEFAULT
CALL criticalError('Boundary type ' // bType // ' undefined', 'readBoundary')
END SELECT
end associate
END DO
END DO
@ -895,6 +916,7 @@ MODULE moduleInput
USE moduleMeshInputGmsh2, ONLY: initGmsh2
USE moduleMeshInputVTU, ONLY: initVTU
USE moduleMeshInput0D, ONLY: init0D
USE moduleMeshInputText, ONLY: initText
USE moduleMesh3DCart
USE moduleMesh2DCyl
USE moduleMesh2DCart
@ -912,7 +934,6 @@ MODULE moduleInput
LOGICAL:: found
CHARACTER(:), ALLOCATABLE:: meshFormat, meshFile
REAL(8):: volume
CHARACTER(:), ALLOCATABLE:: meshFileVTU !Temporary to test VTU OUTPUT
object = 'geometry'
@ -954,9 +975,9 @@ MODULE moduleInput
!Read the 0D mesh
CALL mesh%readMesh(pathMeshParticle)
!Get the volumne
!Get the volume
CALL config%get(object // '.volume', volume, found)
!Rescale the volumne
!Rescale the volume
IF (found) THEN
mesh%cells(1)%obj%volume = mesh%cells(1)%obj%volume*volume / Vol_ref
mesh%nodes(1)%obj%v = mesh%cells(1)%obj%volume
@ -1044,6 +1065,20 @@ MODULE moduleInput
END IF
case ("text")
!Check if the geometry is right.
if (mesh%dimen /= 1) then
call criticalError("Text mesh is only allowed for 1D geometries", 'readGeometry')
end if
!Read the mesh
call initText(mesh)
if (doubleMesh) then
call initText(meshColl)
end if
CASE DEFAULT
CALL criticalError('Mesh format ' // meshFormat // ' not defined.', 'readGeometry')
@ -1090,13 +1125,13 @@ MODULE moduleInput
TYPE(json_file), INTENT(inout):: config
CHARACTER(:), ALLOCATABLE:: object
LOGICAL:: found
CHARACTER(2):: istring
CHARACTER(2):: iString
INTEGER:: i
CHARACTER(:), ALLOCATABLE:: speciesName
REAL(8), ALLOCATABLE, DIMENSION(:):: r
REAL(8), ALLOCATABLE, DIMENSION(:):: v1, v2, v3
INTEGER, ALLOCATABLE, DIMENSION(:):: points
REAL(8):: timeStep
REAL(8):: everyTimeStep
CALL config%info('output.probes', found, n_children = nProbes)
@ -1104,7 +1139,7 @@ MODULE moduleInput
DO i = 1, nProbes
WRITE(iString, '(I2)') i
object = 'output.probes(' // trim(istring) // ')'
object = 'output.probes(' // trim(iString) // ')'
CALL config%get(object // '.species', speciesName, found)
CALL config%get(object // '.position', r, found)
@ -1112,16 +1147,14 @@ MODULE moduleInput
CALL config%get(object // '.velocity_2', v2, found)
CALL config%get(object // '.velocity_3', v3, found)
CALL config%get(object // '.points', points, found)
CALL config%get(object // '.timeStep', timeStep, found)
CALL config%get(object // '.timeStep', everyTimeStep, found)
IF (ANY(points < 2)) CALL criticalError("Number of points in probe " // iString // " incorrect", 'readProbes')
CALL probe(i)%init(i, speciesName, r, v1, v2, v3, points, timeStep)
CALL probe(i)%init(i, speciesName, r, v1, v2, v3, points, everyTimeStep)
END DO
CALL resetProbes(tInitial)
END SUBROUTINE readProbes
SUBROUTINE readEMBoundary(config)
@ -1129,7 +1162,6 @@ MODULE moduleInput
USE moduleOutput
USE moduleErrors
USE moduleEM
USE moduleRefParam
USE moduleSpecies
USE json_module
IMPLICIT NONE
@ -1137,34 +1169,72 @@ MODULE moduleInput
TYPE(json_file), INTENT(inout):: config
CHARACTER(:), ALLOCATABLE:: object
LOGICAL:: found
CHARACTER(2):: istring
INTEGER:: i, e, s
CHARACTER(:), ALLOCATABLE:: typeEM
REAL(8):: potential
INTEGER:: physicalSurface
CHARACTER(:), ALLOCATABLE:: temporalProfile, temporalProfilePath
INTEGER:: b, s, n, ni
CHARACTER(2):: bString
INTEGER:: info
EXTERNAL:: dgetrf
CALL config%info('boundaryEM', found, n_children = nBoundaryEM)
IF (found) ALLOCATE(boundEM(1:nBoundaryEM))
IF (found) THEN
ALLOCATE(boundaryEM(1:nBoundaryEM))
DO i = 1, nBoundaryEM
WRITE(istring, '(I2)') i
object = 'boundaryEM(' // trim(istring) // ')'
END IF
CALL config%get(object // '.type', boundEM(i)%typeEM, found)
DO b = 1, nBoundaryEM
WRITE(bString, '(I2)') b
object = 'boundaryEM(' // TRIM(bString) // ')'
SELECT CASE(boundEM(i)%typeEM)
CALL config%get(object // '.type', typeEM, found)
SELECT CASE(typeEM)
CASE ("dirichlet")
CALL config%get(object // '.potential', boundEM(i)%potential, found)
IF (.NOT. found) &
CALL config%get(object // '.potential', potential, found)
IF (.NOT. found) THEN
CALL criticalError('Required parameter "potential" for Dirichlet boundary condition not found', 'readEMBoundary')
boundEM(i)%potential = boundEM(i)%potential/Volt_ref
CALL config%get(object // '.physicalSurface', boundEM(i)%physicalSurface, found)
IF (.NOT. found) &
CALL criticalError('Required parameter "physicalSurface" for Dirichlet boundary condition not found', 'readEMBoundary')
END IF
CALL config%get(object // '.physicalSurface', physicalSurface, found)
IF (.NOT. found) THEN
CALL criticalError('Required parameter "physicalSurface" for Dirichlet boundary condition not found', &
'readEMBoundary')
END IF
CALL initDirichlet(boundaryEM(b)%obj, physicalSurface, potential)
CASE ("dirichletTime")
CALL config%get(object // '.potential', potential, found)
IF (.NOT. found) THEN
CALL criticalError('Required parameter "potential" for Dirichlet Time boundary condition not found', &
'readEMBoundary')
END IF
CALL config%get(object // '.temporalProfile', temporalProfile, found)
IF (.NOT. found) THEN
CALL criticalError('Required parameter "temporalProfile" for Dirichlet Time boundary condition not found', &
'readEMBoundary')
END IF
temporalProfilePath = path // temporalProfile
CALL config%get(object // '.physicalSurface', physicalSurface, found)
IF (.NOT. found) THEN
CALL criticalError('Required parameter "physicalSurface" for Dirichlet Time boundary condition not found', &
'readEMBoundary')
END IF
CALL initDirichletTime(boundaryEM(b)%obj, physicalSurface, potential, temporalProfilePath)
CASE DEFAULT
CALL criticalError('Boundary type ' // boundEM(i)%typeEM // ' not yet supported', 'readEMBoundary')
CALL criticalError('Boundary type ' // typeEM // ' not yet supported', 'readEMBoundary')
END SELECT
@ -1183,18 +1253,28 @@ MODULE moduleInput
END DO
IF (ALLOCATED(boundEM)) THEN
DO e = 1, mesh%numEdges
IF (ANY(mesh%edges(e)%obj%physicalSurface == boundEM(:)%physicalSurface)) THEN
DO i = 1, nBoundaryEM
IF (mesh%edges(e)%obj%physicalSurface == boundEM(i)%physicalSurface) THEN
CALL boundEM(i)%apply(mesh%edges(e)%obj)
! Modify K matrix due to boundary conditions
DO b = 1, nBoundaryEM
SELECT TYPE(boundary => boundaryEM(b)%obj)
TYPE IS(boundaryEMDirichlet)
DO n = 1, boundary%nNodes
ni = boundary%nodes(n)%obj%n
mesh%K(ni, :) = 0.D0
mesh%K(ni, ni) = 1.D0
END IF
END DO
END IF
TYPE IS(boundaryEMDirichletTime)
DO n = 1, boundary%nNodes
ni = boundary%nodes(n)%obj%n
mesh%K(ni, :) = 0.D0
mesh%K(ni, ni) = 1.D0
END DO
END SELECT
END DO
END IF
!Compute the PLU factorization of K once boundary conditions have been read
CALL dgetrf(mesh%numNodes, mesh%numNodes, mesh%K, mesh%numNodes, mesh%IPIV, info)
@ -1215,24 +1295,25 @@ MODULE moduleInput
TYPE(json_file), INTENT(inout):: config
INTEGER:: i
CHARACTER(2):: istring
CHARACTER(2):: iString
CHARACTER(:), ALLOCATABLE:: object
LOGICAL:: found
CHARACTER(:), ALLOCATABLE:: speciesName
CHARACTER(:), ALLOCATABLE:: name
REAL(8):: v
REAL(8), ALLOCATABLE:: T(:), normal(:)
REAL(8), ALLOCATABLE:: temperature(:), normal(:)
REAL(8):: flow
CHARACTER(:), ALLOCATABLE:: units
INTEGER:: physicalSurface
INTEGER:: particlesPerEdge
INTEGER:: sp
CALL config%info('inject', found, n_children = nInject)
ALLOCATE(inject(1:nInject))
nPartInj = 0
DO i = 1, nInject
WRITE(istring, '(i2)') i
object = 'inject(' // trim(istring) // ')'
WRITE(iString, '(i2)') i
object = 'inject(' // trim(iString) // ')'
!Find species
CALL config%get(object // '.species', speciesName, found)
@ -1240,7 +1321,7 @@ MODULE moduleInput
CALL config%get(object // '.name', name, found)
CALL config%get(object // '.v', v, found)
CALL config%get(object // '.T', T, found)
CALL config%get(object // '.T', temperature, found)
CALL config%get(object // '.n', normal, found)
IF (.NOT. found) THEN
ALLOCATE(normal(1:3))
@ -1249,8 +1330,10 @@ MODULE moduleInput
CALL config%get(object // '.flow', flow, found)
CALL config%get(object // '.units', units, found)
CALL config%get(object // '.physicalSurface', physicalSurface, found)
particlesPerEdge = 0
CALL config%get(object // '.particlesPerEdge', particlesPerEdge, found)
CALL inject(i)%init(i, v, normal, T, flow, units, sp, physicalSurface)
CALL inject(i)%init(i, v, normal, temperature, flow, units, sp, physicalSurface, particlesPerEdge)
CALL readVelDistr(config, inject(i), object)
@ -1269,6 +1352,7 @@ MODULE moduleInput
USE moduleCaseParam, ONLY: tauMin
USE moduleMesh, ONLY: mesh
USE moduleSpecies, ONLY: nSpecies
USE moduleRefParam, ONLY: ti_ref
IMPLICIT NONE
TYPE(json_file), INTENT(inout):: config
@ -1282,7 +1366,10 @@ MODULE moduleInput
CALL config%get('average.startTime', tStart, found)
IF (found) THEN
tAverageStart = INT(tStart / tauMin)
tAverageStart = INT(tStart / ti_ref / tauMin)
ELSE
tAverageStart = 0
END IF
@ -1310,28 +1397,28 @@ MODULE moduleInput
TYPE(injectGeneric), INTENT(inout):: inj
CHARACTER(:), ALLOCATABLE, INTENT(in):: object
INTEGER:: i
CHARACTER(2):: istring
CHARACTER(2):: iString
CHARACTER(:), ALLOCATABLE:: fvType
LOGICAL:: found
REAL(8):: v, T, m
REAL(8):: v, temperature, m
!Reads species mass
m = inj%species%m
!Reads distribution functions for velocity
DO i = 1, 3
WRITE(istring, '(i2)') i
CALL config%get(object // '.velDist('// TRIM(istring) //')', fvType, found)
IF (.NOT. found) CALL criticalError("No velocity distribution in direction " // istring // &
WRITE(iString, '(i2)') i
CALL config%get(object // '.velDist('// TRIM(iString) //')', fvType, found)
IF (.NOT. found) CALL criticalError("No velocity distribution in direction " // iString // &
" found for " // object, 'readVelDistr')
SELECT CASE(fvType)
CASE ("Maxwellian")
T = inj%T(i)
CALL initVelDistMaxwellian(inj%v(i)%obj, t, m)
temperature = inj%temperature(i)
CALL initVelDistMaxwellian(inj%v(i)%obj, temperature, m)
CASE ("Half-Maxwellian")
T = inj%T(i)
CALL initVelDistHalfMaxwellian(inj%v(i)%obj, t, m)
temperature = inj%temperature(i)
CALL initVelDistHalfMaxwellian(inj%v(i)%obj, temperature, m)
CASE ("Delta")
v = inj%vMod*inj%n(i)
@ -1372,5 +1459,37 @@ MODULE moduleInput
END SUBROUTINE readParallel
SUBROUTINE initOutput(inputFile)
USE moduleRefParam
USE moduleMesh, ONLY: mesh, doubleMesh, pathMeshParticle, pathMeshColl
USE moduleOutput, ONLY: path, folder
IMPLICIT NONE
CHARACTER(:), ALLOCATABLE, INTENT(in):: inputFile
INTEGER:: fileReference = 30
!If everything is correct, creates the output folder
CALL EXECUTE_COMMAND_LINE('mkdir ' // path // folder )
!Copies input file to output folder
CALL EXECUTE_COMMAND_LINE('cp ' // inputFile // ' ' // path // folder)
!Copies particle mesh
IF (mesh%dimen > 0) THEN
CALL EXECUTE_COMMAND_LINE('cp ' // pathMeshParticle // ' ' // path // folder)
IF (doubleMesh) THEN
CALL EXECUTE_COMMAND_LINE('cp ' // pathMeshColl // ' ' // path // folder)
END IF
END IF
! Write commit of fpakc
CALL SYSTEM('git rev-parse HEAD > ' // path // folder // '/' // 'fpakc_commit.txt')
! Write file with reference values
OPEN (fileReference, file=path // folder // '/' // 'reference.txt')
WRITE(fileReference, "(7(1X,A20))") 'L_ref', 'v_ref', 'ti_ref', 'Vol_ref', 'EF_ref', 'Volt_ref', 'B_ref'
WRITE(fileReference, "(7(1X,ES20.6E3))") L_ref, v_ref, ti_ref, Vol_ref, EF_ref, Volt_ref, B_ref
CLOSE(fileReference)
END SUBROUTINE initOutput
END MODULE moduleInput

View file

@ -122,6 +122,8 @@ MODULE moduleMesh1DCart
self%x = r1(1)
self%surface = 1.D0
self%normal = (/ 1.D0, 0.D0, 0.D0 /)
!Boundary index

View file

@ -122,6 +122,8 @@ MODULE moduleMesh1DRad
self%r = r1(1)
self%surface = 1.D0
self%normal = (/ 1.D0, 0.D0, 0.D0 /)
!Boundary index

View file

@ -163,7 +163,7 @@ MODULE moduleMesh2DCart
r2 = self%n2%getCoordinates()
self%x = (/r1(1), r2(1)/)
self%y = (/r1(2), r2(2)/)
self%weight = 1.D0
self%surface = SQRT((self%x(2) - self%x(1))**2 + (self%y(2) - self%y(1))**2)
!Normal vector
self%normal = (/ -(self%y(2)-self%y(1)), &
self%x(2)-self%x(1) , &
@ -318,6 +318,8 @@ MODULE moduleMesh2DCart
INTEGER, INTENT(in):: nNodes
REAL(8):: fPsi(1:nNodes)
fPsi = 0.D0
fPsi = (/ (1.D0 - Xi(1)) * (1.D0 - Xi(2)), &
(1.D0 + Xi(1)) * (1.D0 - Xi(2)), &
(1.D0 + Xi(1)) * (1.D0 + Xi(2)), &
@ -492,34 +494,36 @@ MODULE moduleMesh2DCart
END FUNCTION insideQuad
!Transform physical coordinates to element coordinates
!Transform physical coordinates to element coordinates with a Taylor series
PURE FUNCTION phy2logQuad(self,r) RESULT(Xi)
IMPLICIT NONE
CLASS(meshCell2DCartQuad), INTENT(in):: self
REAL(8), INTENT(in):: r(1:3)
REAL(8):: Xi(1:3)
REAL(8):: XiO(1:3), detJ, invJ(1:3,1:3), f(1:3)
REAL(8):: Xi0(1:3), detJ, pDerInv(1:2,1:2), deltaR(1:2), x0(1:2)
REAL(8):: dPsi(1:3,1:4), fPsi(1:4)
REAL(8):: pDer(1:3, 1:3)
REAL(8):: conv
!Iterative newton method to transform coordinates
conv = 1.D0
XiO = 0.D0
Xi0 = 0.D0
Xi(3) = 0.D0
DO WHILE(conv > 1.D-4)
dPsi = self%dPsi(XiO, 4)
fPsi = self%fPsi(Xi0, 4)
x0(1) = dot_product(fPsi, self%x)
x0(2) = dot_product(fPsi, self%y)
deltaR = r(1:2) - x0
dPsi = self%dPsi(Xi0, 4)
pDer = self%partialDer(4, dPsi)
detJ = self%detJac(pDer)
invJ = self%invJac(pDer)
fPsi = self%fPsi(XiO, 4)
f = (/ DOT_PRODUCT(fPsi,self%x), &
DOT_PRODUCT(fPsi,self%y), &
0.D0 /) - r
Xi = XiO - MATMUL(invJ, f)/detJ
conv = MAXVAL(DABS(Xi-XiO),1)
XiO = Xi
pDerInv(1,1:2) = (/ pDer(2,2), -pDer(1,2) /)
pDerInv(2,1:2) = (/ -pDer(2,1), pDer(1,1) /)
Xi(1:2) = Xi0(1:2) + MATMUL(pDerInv, deltaR)/detJ
conv = MAXVAL(DABS(Xi(1:2)-Xi0(1:2)),1)
Xi0(1:2) = Xi(1:2)
END DO
@ -569,6 +573,7 @@ MODULE moduleMesh2DCart
pDer = self%partialDer(4, dPsi)
detJ = self%detJac(pDer)
fPsi = self%fPsi(Xi, 4)
!Compute total volume of the cell
self%volume = detJ*4.D0
!Compute volume per node
@ -675,8 +680,8 @@ MODULE moduleMesh2DCart
dPsi = 0.D0
dPsi(1,:) = (/ -1.D0, 1.D0, 0.D0 /)
dPsi(2,:) = (/ -1.D0, 0.D0, 1.D0 /)
dPsi(1,1:3) = (/ -1.D0, 1.D0, 0.D0 /)
dPsi(2,1:3) = (/ -1.D0, 0.D0, 1.D0 /)
END FUNCTION dPsiTria
@ -762,6 +767,7 @@ MODULE moduleMesh2DCart
pDer = self%partialDer(3, dPsi)
detJ = self%detJac(pDer)
invJ = self%invJac(pDer)
localK = localK + MATMUL(TRANSPOSE(MATMUL(invJ,dPsi)),MATMUL(invJ,dPsi))*wTria(l)/detJ
END DO
@ -820,19 +826,19 @@ MODULE moduleMesh2DCart
CLASS(meshCell2DCartTria), INTENT(in):: self
REAL(8), INTENT(in):: r(1:3)
REAL(8):: Xi(1:3)
REAL(8):: deltaR(1:3)
REAL(8):: dPsi(1:3, 1:3)
REAL(8):: detJ, pDerInv(1:2,1:2), deltaR(1:2)
REAL(8):: dPsi(1:3,1:4)
REAL(8):: pDer(1:3, 1:3)
REAL(8):: invJ(1:3, 1:3), detJ
!Direct method to convert coordinates
Xi = 0.D0
deltaR = (/ r(1) - self%x(1), r(2) - self%y(1), 0.D0 /)
Xi(3) = 0.D0
deltaR = (/ r(1) - self%x(1), r(2) - self%y(1) /)
dPsi = self%dPsi(Xi, 3)
pDer = self%partialDer(3, dPsi)
invJ = self%invJac(pDer)
detJ = self%detJac(pDer)
Xi = MATMUL(invJ,deltaR)/detJ
pDerInv(1,1:2) = (/ pDer(2,2), -pDer(1,2) /)
pDerInv(2,1:2) = (/ -pDer(2,1), pDer(1,1) /)
Xi(1:2) = MATMUL(pDerInv,deltaR)/detJ
END FUNCTION phy2logTria
@ -907,8 +913,8 @@ MODULE moduleMesh2DCart
invJ = 0.D0
invJ(1, 1:2) = (/ pDer(2,2), -pDer(1,2) /)
invJ(2, 1:2) = (/ -pDer(2,1), pDer(1,1) /)
invJ(1, 1:2) = (/ pDer(2,2), -pDer(2,1) /)
invJ(2, 1:2) = (/ -pDer(1,2), pDer(1,1) /)
invJ(3, 3) = 1.D0
END FUNCTION invJ2DCart

View file

@ -144,6 +144,7 @@ MODULE moduleMesh2DCyl
USE moduleSpecies
USE moduleBoundary
USE moduleErrors
USE moduleConstParam, ONLY: PI
IMPLICIT NONE
CLASS(meshEdge2DCyl), INTENT(out):: self
@ -163,7 +164,15 @@ MODULE moduleMesh2DCyl
r2 = self%n2%getCoordinates()
self%z = (/r1(1), r2(1)/)
self%r = (/r1(2), r2(2)/)
self%weight = r2(2)**2 - r1(2)**2
!Edge surface
IF (self%z(2) /= self%z(1)) THEN
self%surface = ABS(self%r(2) + self%r(1))*ABS(self%z(2) - self%z(1))
ELSE
self%surface = ABS(self%r(2)**2 - self%r(1)**2)
END IF
self%surface = self%surface * PI
!Normal vector
self%normal = (/ -(self%r(2)-self%r(1)), &
self%z(2)-self%z(1) , &
@ -223,21 +232,13 @@ MODULE moduleMesh2DCyl
CLASS(meshEdge2DCyl), INTENT(in):: self
REAL(8):: rnd
REAL(8):: r(1:3)
REAL(8):: dr, dz
REAL(8):: p1(1:2), p2(1:2)
rnd = random()
dr = self%r(2) - self%r(1)
dz = self%z(2) - self%z(1)
IF (dr /= 0.D0) THEN
r(2) = dr * DSQRT(rnd) + self%r(1)
r(1) = dz * (r(2) - self%r(1))/dr + self%z(1)
ELSE
r(2) = self%r(1)
r(1) = dz * rnd + self%z(1)
END IF
p1 = (/self%z(1), self%r(1) /)
p2 = (/self%z(2), self%r(2) /)
r(1:2) = (1.D0 - rnd)*p1 + rnd*p2
r(3) = 0.D0
END FUNCTION randPosEdge
@ -246,7 +247,6 @@ MODULE moduleMesh2DCyl
!QUAD FUNCTIONS
!Init element
SUBROUTINE initCellQuad2DCyl(self, n, p, nodes)
USE moduleRefParam
IMPLICIT NONE
CLASS(meshCell2DCylQuad), INTENT(out):: self
@ -326,6 +326,8 @@ MODULE moduleMesh2DCyl
INTEGER, INTENT(in):: nNodes
REAL(8):: fPsi(1:nNodes)
fPsi = 0.D0
fPsi = (/ (1.D0 - Xi(1)) * (1.D0 - Xi(2)), &
(1.D0 + Xi(1)) * (1.D0 - Xi(2)), &
(1.D0 + Xi(1)) * (1.D0 + Xi(2)), &
@ -496,7 +498,7 @@ MODULE moduleMesh2DCyl
END FUNCTION elemFQuad
!Checks if Xi is inside the element
!Check if Xi is inside the element
PURE FUNCTION insideQuad(Xi) RESULT(ins)
IMPLICIT NONE
@ -508,34 +510,36 @@ MODULE moduleMesh2DCyl
END FUNCTION insideQuad
!Transform physical coordinates to element coordinates
!Transform physical coordinates to element coordinates with a Taylor series
PURE FUNCTION phy2logQuad(self,r) RESULT(Xi)
IMPLICIT NONE
CLASS(meshCell2DCylQuad), INTENT(in):: self
REAL(8), INTENT(in):: r(1:3)
REAL(8):: Xi(1:3)
REAL(8):: XiO(1:3), detJ, invJ(1:3,1:3), f(1:3)
REAL(8):: Xi0(1:3), detJ, pDerInv(1:2,1:2), deltaR(1:2), x0(1:2)
REAL(8):: dPsi(1:3,1:4), fPsi(1:4)
REAL(8):: pDer(1:3, 1:3)
REAL(8):: conv
!Iterative newton method to transform coordinates
conv = 1.D0
XiO = 0.D0
Xi0 = 0.D0
Xi(3) = 0.D0
DO WHILE(conv > 1.D-4)
dPsi = self%dPsi(XiO, 4)
fPsi = self%fPsi(Xi0, 4)
x0(1) = dot_product(fPsi, self%z)
x0(2) = dot_product(fPsi, self%r)
deltaR = r(1:2) - x0
dPsi = self%dPsi(Xi0, 4)
pDer = self%partialDer(4, dPsi)
detJ = self%detJac(pDer)
invJ = self%invJac(pDer)
fPsi = self%fPsi(XiO, 4)
f = (/ DOT_PRODUCT(fPsi,self%z), &
DOT_PRODUCT(fPsi,self%r), &
0.D0 /) - r
Xi = XiO - MATMUL(invJ, f)/detJ
conv = MAXVAL(DABS(Xi-XiO),1)
XiO = Xi
pDerInv(1,1:2) = (/ pDer(2,2), -pDer(1,2) /)
pDerInv(2,1:2) = (/ -pDer(2,1), pDer(1,1) /)
Xi(1:2) = Xi0(1:2) + MATMUL(pDerInv, deltaR)/detJ
conv = MAXVAL(DABS(Xi(1:2)-Xi0(1:2)),1)
Xi0(1:2) = Xi(1:2)
END DO
@ -553,7 +557,7 @@ MODULE moduleMesh2DCyl
XiArray = (/ -Xi(2), Xi(1), Xi(2), -Xi(1) /)
nextInt = MAXLOC(XiArray,1)
!Selects the higher value of directions and searches in that direction
!Select the higher value of directions and searches in that direction
NULLIFY(neighbourElement)
SELECT CASE (nextInt)
CASE (1)
@ -581,6 +585,7 @@ MODULE moduleMesh2DCyl
REAL(8):: dPsi(1:3, 1:4), pDer(1:3, 1:3)
self%volume = 0.D0
!2D 1 point Gauss Quad Integral
Xi = 0.D0
dPsi = self%dPsi(Xi, 4)
@ -589,18 +594,18 @@ MODULE moduleMesh2DCyl
fPsi = self%fPsi(Xi, 4)
r = DOT_PRODUCT(fPsi,self%r)
!Computes total volume of the cell
self%volume = r*detJ*PI8 !4*2*pi
!Computes volume per node
Xi = (/-5.D-1, -5.D-1, 0.D0/)
self%volume = r*detJ*PI8 !2*pi * 4 (weight of 1 point 2D-Gaussian integral)
!Computes volume per node. Change the radius point to calculate the area to improve accuracy near the axis.
Xi = (/-5.D-1, -0.25D0, 0.D0/)
r = self%gatherF(Xi, 4, self%r)
self%n1%v = self%n1%v + fPsi(1)*r*detJ*PI8
Xi = (/ 5.D-1, -5.D-1, 0.D0/)
Xi = (/ 5.D-1, -0.25D0, 0.D0/)
r = self%gatherF(Xi, 4, self%r)
self%n2%v = self%n2%v + fPsi(2)*r*detJ*PI8
Xi = (/ 5.D-1, 5.D-1, 0.D0/)
Xi = (/ 5.D-1, 0.75D0, 0.D0/)
r = self%gatherF(Xi, 4, self%r)
self%n3%v = self%n3%v + fPsi(3)*r*detJ*PI8
Xi = (/-5.D-1, 5.D-1, 0.D0/)
Xi = (/-5.D-1, 0.75D0, 0.D0/)
r = self%gatherF(Xi, 4, self%r)
self%n4%v = self%n4%v + fPsi(4)*r*detJ*PI8
@ -702,8 +707,8 @@ MODULE moduleMesh2DCyl
dPsi = 0.D0
dPsi(1,:) = (/ -1.D0, 1.D0, 0.D0 /)
dPsi(2,:) = (/ -1.D0, 0.D0, 1.D0 /)
dPsi(1,1:3) = (/ -1.D0, 1.D0, 0.D0 /)
dPsi(2,1:3) = (/ -1.D0, 0.D0, 1.D0 /)
END FUNCTION dPsiTria
@ -855,19 +860,19 @@ MODULE moduleMesh2DCyl
CLASS(meshCell2DCylTria), INTENT(in):: self
REAL(8), INTENT(in):: r(1:3)
REAL(8):: Xi(1:3)
REAL(8):: deltaR(1:3)
REAL(8):: dPsi(1:3, 1:3)
REAL(8):: detJ, pDerInv(1:2,1:2), deltaR(1:2)
REAL(8):: dPsi(1:3,1:4)
REAL(8):: pDer(1:3, 1:3)
REAL(8):: invJ(1:3, 1:3), detJ
!Direct method to convert coordinates
Xi = 0.D0
deltaR = (/ r(1) - self%z(1), r(2) - self%r(1), 0.D0 /)
Xi(3) = 0.D0
deltaR = (/ r(1) - self%z(1), r(2) - self%r(1) /)
dPsi = self%dPsi(Xi, 3)
pDer = self%partialDer(3, dPsi)
invJ = self%invJac(pDer)
detJ = self%detJac(pDer)
Xi = MATMUL(invJ,deltaR)/detJ
pDerInv(1,1:2) = (/ pDer(2,2), -pDer(1,2) /)
pDerInv(2,1:2) = (/ -pDer(2,1), pDer(1,1) /)
Xi(1:2) = MATMUL(pDerInv,deltaR)/detJ
END FUNCTION phy2logTria
@ -945,8 +950,8 @@ MODULE moduleMesh2DCyl
invJ = 0.D0
invJ(1, 1:2) = (/ pDer(2,2), -pDer(1,2) /)
invJ(2, 1:2) = (/ -pDer(2,1), pDer(1,1) /)
invJ(1, 1:2) = (/ pDer(2,2), -pDer(2,1) /)
invJ(2, 1:2) = (/ -pDer(1,2), pDer(1,1) /)
invJ(3, 3) = 1.D0
END FUNCTION invJ2DCyl

View file

@ -109,6 +109,7 @@ MODULE moduleMesh3DCart
USE moduleBoundary
USE moduleErrors
USE moduleMath
USE moduleRefParam, ONLY: L_ref
IMPLICIT NONE
CLASS(meshEdge3DCartTria), INTENT(out):: self
@ -142,6 +143,8 @@ MODULE moduleMesh3DCart
self%normal = crossProduct(vec1, vec2)
self%normal = normalize(self%normal)
self%surface = 1.D0/L_ref**2 !TODO: FIX THIS WHEN MOVING TO 3D
!Boundary index
self%boundary => boundary(bt)
ALLOCATE(self%fBoundary(1:nSpecies))

View file

@ -1,22 +1,22 @@
MODULE moduleMeshOutput0D
CONTAINS
SUBROUTINE printOutput0D(self, t)
SUBROUTINE printOutput0D(self)
USE moduleMesh
USE moduleRefParam
USE moduleSpecies
USE moduleOutput
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
CLASS(meshParticles), INTENT(in):: self
INTEGER, INTENT(in):: t
INTEGER:: i
TYPE(outputFormat):: output
CHARACTER(:), ALLOCATABLE:: fileName
DO i = 1, nSpecies
fileName='OUTPUT_' // species(i)%obj%name // '.dat'
IF (t == 0) THEN
IF (timeStep == 0) THEN
OPEN(20, file = path // folder // '/' // fileName, action = 'write')
WRITE(20, "(A1, 14X, A5, A20, 40X, A20, 2(A20))") "#","t (s)","density (m^-3)", "velocity (m/s)", &
"pressure (Pa)", "temperature (K)"
@ -27,14 +27,17 @@ MODULE moduleMeshOutput0D
OPEN(20, file = path // folder // '/' // fileName, position = 'append', action = 'write')
CALL calculateOutput(self%nodes(1)%obj%output(i), output, self%nodes(1)%obj%v, species(i)%obj)
WRITE(20, "(7(ES20.6E3))") REAL(t)*tauMin*ti_ref, output%density, output%velocity, output%pressure, output%temperature
WRITE(20, "(7(ES20.6E3))") REAL(timeStep)*tauMin*ti_ref, output%density, &
output%velocity, &
output%pressure, &
output%temperature
CLOSE(20)
END DO
END SUBROUTINE printOutput0D
SUBROUTINE printColl0D(self, t)
SUBROUTINE printColl0D(self)
USE moduleMesh
USE moduleRefParam
USE moduleCaseParam
@ -43,12 +46,11 @@ MODULE moduleMeshOutput0D
IMPLICIT NONE
CLASS(meshGeneric), INTENT(in):: self
INTEGER, INTENT(in):: t
CHARACTER(:), ALLOCATABLE:: fileName
INTEGER:: k
fileName='OUTPUT_Collisions.dat'
IF (t == tInitial) THEN
IF (timeStep == tInitial) THEN
OPEN(20, file = path // folder // '/' // fileName, action = 'write')
WRITE(20, "(A1, 14X, A5, A20)") "#","t (s)","collisions"
WRITE(*, "(6X,A15,A)") "Creating file: ", fileName
@ -57,12 +59,12 @@ MODULE moduleMeshOutput0D
END IF
OPEN(20, file = path // folder // '/' // fileName, position = 'append', action = 'write')
WRITE(20, "(ES20.6E3, 10I20)") REAL(t)*tauMin*ti_ref, (self%cells(1)%obj%tallyColl(k)%tally, k=1,nCollPairs)
WRITE(20, "(ES20.6E3, 10I20)") REAL(timeStep)*tauMin*ti_ref, (self%cells(1)%obj%tallyColl(k)%tally, k=1,nCollPairs)
CLOSE(20)
END SUBROUTINE printColl0D
SUBROUTINE printEM0D(self, t)
SUBROUTINE printEM0D(self)
USE moduleMesh
USE moduleRefParam
USE moduleCaseParam
@ -70,7 +72,6 @@ MODULE moduleMeshOutput0D
IMPLICIT NONE
CLASS(meshParticles), INTENT(in):: self
INTEGER, INTENT(in):: t
END SUBROUTINE printEM0D

View file

@ -108,6 +108,7 @@ MODULE moduleMeshInputGmsh2
READ(10, *) totalNumElem
!Count edges and volume elements
numEdges = 0
SELECT TYPE(self)
TYPE IS(meshParticles)
self%numEdges = 0
@ -328,7 +329,7 @@ MODULE moduleMeshInputGmsh2
DO i = 1, numNodes
!Reads the density
READ(10, *), e, density(i)
READ(10, *) e, density(i)
END DO
@ -339,7 +340,7 @@ MODULE moduleMeshInputGmsh2
DO i = 1, numNodes
!Reads the velocity
READ(10, *), e, velocity(i, 1:3)
READ(10, *) e, velocity(i, 1:3)
END DO

View file

@ -80,50 +80,50 @@ MODULE moduleMeshOutputGmsh2
END SUBROUTINE writeGmsh2FooterElementData
!Prints the scattered properties of particles into the nodes
SUBROUTINE printOutputGmsh2(self, t)
SUBROUTINE printOutputGmsh2(self)
USE moduleMesh
USE moduleRefParam
USE moduleSpecies
USE moduleOutput
USE moduleMeshInoutCommon
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
CLASS(meshParticles), INTENT(in):: self
INTEGER, INTENT(in):: t
INTEGER:: n, i
TYPE(outputFormat):: output(1:self%numNodes)
REAL(8):: time
CHARACTER(:), ALLOCATABLE:: fileName
time = DBLE(t)*tauMin*ti_ref
time = DBLE(timeStep)*tauMin*ti_ref
DO i = 1, nSpecies
fileName = formatFileName(prefix, species(i)%obj%name, 'msh', t)
fileName = formatFileName(prefix, species(i)%obj%name, 'msh', timeStep)
WRITE(*, "(6X,A15,A)") "Creating file: ", fileName
OPEN (60, file = path // folder // '/' // fileName)
CALL writeGmsh2HeaderMesh(60)
CALL writeGmsh2HeaderNodeData(60, species(i)%obj%name // ' density (m^-3)', t, time, 1, self%numNodes)
CALL writeGmsh2HeaderNodeData(60, species(i)%obj%name // ' density (m^-3)', timeStep, time, 1, self%numNodes)
DO n=1, self%numNodes
CALL calculateOutput(self%nodes(n)%obj%output(i), output(n), self%nodes(n)%obj%v, species(i)%obj)
WRITE(60, "(I6,ES20.6E3)") n, output(n)%density
END DO
CALL writeGmsh2FooterNodeData(60)
CALL writeGmsh2HeaderNodeData(60, species(i)%obj%name // ' velocity (m s^-1)', t, time, 3, self%numNodes)
CALL writeGmsh2HeaderNodeData(60, species(i)%obj%name // ' velocity (m s^-1)', timeStep, time, 3, self%numNodes)
DO n=1, self%numNodes
WRITE(60, "(I6,3(ES20.6E3))") n, output(n)%velocity
END DO
CALL writeGmsh2FooterNodeData(60)
CALL writeGmsh2HeaderNodeData(60, species(i)%obj%name // ' Pressure (Pa)', t, time, 1, self%numNodes)
CALL writeGmsh2HeaderNodeData(60, species(i)%obj%name // ' Pressure (Pa)', timeStep, time, 1, self%numNodes)
DO n=1, self%numNodes
WRITE(60, "(I6,3(ES20.6E3))") n, output(n)%pressure
END DO
CALL writeGmsh2FooterNodeData(60)
CALL writeGmsh2HeaderNodeData(60, species(i)%obj%name // ' Temperature (K)', t, time, 1, self%numNodes)
CALL writeGmsh2HeaderNodeData(60, species(i)%obj%name // ' Temperature (K)', timeStep, time, 1, self%numNodes)
DO n=1, self%numNodes
WRITE(60, "(I6,3(ES20.6E3))") n, output(n)%temperature
END DO
@ -135,7 +135,7 @@ MODULE moduleMeshOutputGmsh2
END SUBROUTINE printOutputGmsh2
!Prints the number of collisions into the volumes
SUBROUTINE printCollGmsh2(self, t)
SUBROUTINE printCollGmsh2(self)
USE moduleMesh
USE moduleRefParam
USE moduleCaseParam
@ -145,7 +145,6 @@ MODULE moduleMeshOutputGmsh2
IMPLICIT NONE
CLASS(meshGeneric), INTENT(in):: self
INTEGER, INTENT(in):: t
INTEGER:: numEdges
INTEGER:: k, c
INTEGER:: n
@ -167,9 +166,9 @@ MODULE moduleMeshOutputGmsh2
END SELECT
IF (collOutput) THEN
time = DBLE(t)*tauMin*ti_ref
time = DBLE(timeStep)*tauMin*ti_ref
fileName = formatFileName(prefix, 'Collisions', 'msh', t)
fileName = formatFileName(prefix, 'Collisions', 'msh', timeStep)
WRITE(*, "(6X,A15,A)") "Creating file: ", fileName
OPEN (60, file = path // folder // '/' // fileName)
@ -179,7 +178,7 @@ MODULE moduleMeshOutputGmsh2
DO c = 1, interactionMatrix(k)%amount
WRITE(cString, "(I2)") c
title = '"Pair ' // interactionMatrix(k)%sp_i%name // '-' // interactionMatrix(k)%sp_j%name // ' collision ' // cString
CALL writeGmsh2HeaderElementData(60, title, t, time, 1, self%numCells)
CALL writeGmsh2HeaderElementData(60, title, timeStep, time, 1, self%numCells)
DO n=1, self%numCells
WRITE(60, "(I6,I10)") n + numEdges, self%cells(n)%obj%tallyColl(k)%tally(c)
END DO
@ -196,7 +195,7 @@ MODULE moduleMeshOutputGmsh2
END SUBROUTINE printCollGmsh2
!Prints the electrostatic EM properties into the nodes and volumes
SUBROUTINE printEMGmsh2(self, t)
SUBROUTINE printEMGmsh2(self)
USE moduleMesh
USE moduleRefParam
USE moduleCaseParam
@ -205,7 +204,6 @@ MODULE moduleMeshOutputGmsh2
IMPLICIT NONE
CLASS(meshParticles), INTENT(in):: self
INTEGER, INTENT(in):: t
INTEGER:: n, e
REAL(8):: time
CHARACTER(:), ALLOCATABLE:: fileName
@ -214,27 +212,27 @@ MODULE moduleMeshOutputGmsh2
Xi = (/ 0.D0, 0.D0, 0.D0 /)
IF (emOutput) THEN
time = DBLE(t)*tauMin*ti_ref
time = DBLE(timeStep)*tauMin*ti_ref
fileName = formatFileName(prefix, 'EMField', 'msh', t)
fileName = formatFileName(prefix, 'EMField', 'msh', timeStep)
WRITE(*, "(6X,A15,A)") "Creating file: ", fileName
OPEN (20, file = path // folder // '/' // fileName)
CALL writeGmsh2HeaderMesh(20)
CALL writeGmsh2HeaderNodeData(20, 'Potential (V)', t, time, 1, self%numNodes)
CALL writeGmsh2HeaderNodeData(20, 'Potential (V)', timeStep, time, 1, self%numNodes)
DO n=1, self%numNodes
WRITE(20, *) n, self%nodes(n)%obj%emData%phi*Volt_ref
END DO
CALL writeGmsh2FooterNodeData(20)
CALL writeGmsh2HeaderElementData(20, 'Electric Field (V m^-1)', t, time, 3, self%numCells)
CALL writeGmsh2HeaderElementData(20, 'Electric Field (V m^-1)', timeStep, time, 3, self%numCells)
DO e=1, self%numCells
WRITE(20, *) e+self%numEdges, self%cells(e)%obj%gatherElectricField(Xi)*EF_ref
END DO
CALL writeGmsh2FooterElementData(20)
CALL writeGmsh2HeaderNodeData(20, 'Magnetic Field (T)', t, time, 3, self%numNodes)
CALL writeGmsh2HeaderNodeData(20, 'Magnetic Field (T)', timeStep, time, 3, self%numNodes)
DO n=1, self%numNodes
WRITE(20, *) n, self%nodes(n)%obj%emData%B * B_ref
END DO

View file

@ -1,4 +1,4 @@
all: vtu.o gmsh2.o 0D.o
all: vtu.o gmsh2.o 0D.o text.o
vtu.o: moduleMeshInoutCommon.o
$(MAKE) -C vtu all
@ -9,5 +9,8 @@ gmsh2.o:
0D.o:
$(MAKE) -C 0D all
text.o:
$(MAKE) -C text all
%.o: %.f90
$(FC) $(FCFLAGS) -c $< -o $(OBJDIR)/$@

View file

@ -3,17 +3,17 @@ MODULE moduleMeshInoutCommon
CHARACTER(LEN=4):: prefix = 'Step'
CONTAINS
PURE FUNCTION formatFileName(prefix, suffix, extension, t) RESULT(fileName)
PURE FUNCTION formatFileName(prefix, suffix, extension, timeStep) RESULT(fileName)
USE moduleOutput
IMPLICIT NONE
CHARACTER(*), INTENT(in):: prefix, suffix, extension
INTEGER, INTENT(in), OPTIONAL:: t
INTEGER, INTENT(in), OPTIONAL:: timeStep
CHARACTER (LEN=iterationDigits):: tString
CHARACTER(:), ALLOCATABLE:: fileName
IF (PRESENT(t)) THEN
WRITE(tString, iterationFormat) t
IF (PRESENT(timeStep)) THEN
WRITE(tString, iterationFormat) timeStep
fileName = prefix // '_' // tString // '_' // suffix // '.' // extension
ELSE

View file

@ -0,0 +1,7 @@
all: moduleMeshInputText.o moduleMeshOutputText.o
moduleMeshInputText.o: moduleMeshOutputText.o moduleMeshInputText.f90
$(FC) $(FCFLAGS) -c $(subst .o,.f90,$@) -o $(OBJDIR)/$@
%.o: %.f90
$(FC) $(FCFLAGS) -c $< -o $(OBJDIR)/$@

View file

@ -0,0 +1,232 @@
module moduleMeshInputText
!The mesh is stored as a column-wise text file.
!Aimed for simple geometries in 1D
contains
!Inits the text mesh
subroutine initText(self)
use moduleMesh
use moduleMeshOutputText
implicit none
class(meshGeneric), intent(inout), target:: self
if (associated(meshForMCC,self)) then
self%printColl => printCollText
end if
select type(self)
type is (meshParticles)
self%printOutput => printOutputText
self%printEM => printEMText
self%printAverage => printAverageText
self%readInitial => readInitialText
end select
self%readMesh => readText
end subroutine initText
!Reads the text mesh
subroutine readText(self, filename)
use moduleMesh
use moduleMesh1DCart
use moduleMesh1DRad
use moduleErrors
implicit none
class(meshGeneric), intent(inout):: self
character(:), allocatable, intent(in):: filename !Dummy file, not used
integer:: fileID, reason
character(len=256):: line
integer:: nNodes
real(8):: r(1:3) !dummy 3D coordinate
integer:: physicalID
integer:: n, c
integer, allocatable:: p(:)
integer:: bt
fileID = 10
open(fileID, file=trim(filename))
!Skip header
read(fileID, *)
!Get number of nodes
nNodes = 0
do
read(fileID, *, iostat=reason) line
if (reason > 0) then
call criticalError('Error reading mesh file', 'readText')
else if (reason < 0) then
exit
else if (len(line) > 0) then
nNodes = nNodes + 1
end if
end do
if (nNodes == 0) then
call criticalError('No nodes read in mesh file', 'readText')
end if
self%numNodes = nNodes
allocate(self%nodes(1:self%numNodes))
SELECT TYPE(self)
TYPE IS(meshParticles)
ALLOCATE(self%K(1:self%numNodes, 1:self%numNodes))
ALLOCATE(self%IPIV(1:self%numNodes, 1:self%numNodes))
self%K = 0.D0
self%IPIV = 0
END SELECT
self%numCells = nNodes - 1
allocate(self%cells(1:self%numCells))
select type(self)
type is (meshParticles)
self%numEdges = 2
allocate(self%edges(1:self%numEdges))
end select
!Read the mesh now
rewind(fileID)
!Skip header
read(fileID, *)
!Allocate nodes and edges
do n = 1, self%numNodes
r = 0.D0
read(fileID, *) r(1), physicalID
select case(self%geometry)
case("Cart")
allocate(meshNode1DCart:: self%nodes(n)%obj)
case("Rad")
allocate(meshNode1DRad:: self%nodes(n)%obj)
end select
!Init nodes
call self%nodes(n)%obj%init(n, r)
!Allocate edges if required)
select type(self)
type is (meshParticles)
if ((physicalID == 1) .or. (physicalID == 2)) then
select case(self%geometry)
case("Cart")
allocate(meshEdge1DCart:: self%edges(physicalID)%obj)
case("Rad")
allocate(meshEdge1DRad:: self%edges(physicalID)%obj)
end select
allocate(p(1))
p(1) = n
bt = getBoundaryId(physicalID)
call self%edges(physicalID)%obj%init(physicalID, p, physicalID, physicalID)
deallocate(p)
end if
end select
end do
!Allocate cells
n = 1
allocate(p(1:2))
do c = 1, self%numCells
p(1) = n
n = n + 1
p(2) = n
select case(self%geometry)
case("Cart")
allocate(meshCell1DCartSegm:: self%cells(c)%obj)
case("Rad")
allocate(meshCell1DRadSegm:: self%cells(c)%obj)
end select
call self%cells(c)%obj%init(c, p, self%nodes)
end do
deallocate(p)
close(fileID)
!Call mesh connectivity
CALL self%connectMesh
end subroutine readText
subroutine readInitialText(filename, density, velocity, temperature)
use moduleErrors
implicit none
character(:), allocatable, intent(in):: filename
real(8), allocatable, intent(out), dimension(:):: density
real(8), allocatable, intent(out), dimension(:,:):: velocity
real(8), allocatable, intent(out), dimension(:):: temperature
integer:: fileID, reason
character(len=256):: line
integer:: nNodes
integer:: n
fileID = 10
open(fileID, file=trim(filename))
do
read(fileID, *, iostat=reason) line
if (reason > 0) then
call criticalError('Error reading mesh file', 'readText')
else if (reason < 0) then
exit
else if (len(line) > 0) then
nNodes = nNodes + 1
end if
end do
allocate(density(1:nNodes))
allocate(velocity(1:nNodes, 1:3))
allocate(temperature(1:nNodes))
rewind(fileID)
do n = 1, nNodes
read(fileID, *) density(n), velocity(n, 1:3), temperature(n)
end do
close(fileID)
end subroutine readInitialText
end module moduleMeshInputText

View file

@ -0,0 +1,265 @@
module moduleMeshOutputText
contains
subroutine writeSpeciesOutput(self, fileID, speciesIndex)
use moduleMesh
use moduleOutput
use moduleRefParam, only: L_ref
implicit none
class(meshParticles), INTENT(in):: self
integer, intent(in):: fileID
integer, intent(in):: speciesIndex
real(8):: r(1:3)
type(outputFormat):: output
integer:: n
do n = 1, self%numNodes
r = self%nodes(n)%obj%getCoordinates()
call calculateOutput(self%nodes(n)%obj%output(speciesIndex), output, self%nodes(n)%obj%v, species(speciesIndex)%obj)
write(fileID, '(5(ES0.6E3,","),ES0.6E3)') r(1)*L_ref, output%density, output%velocity, output%temperature
end do
end subroutine writeSpeciesOutput
subroutine writeCollOutput(self, fileID)
use moduleMesh
use moduleCollisions
use moduleRefParam, only: L_ref
implicit none
class(meshGeneric), intent(in):: self
integer, intent(in):: fileID
integer:: n, k, c
do n = 1, self%numCells
write(fileID, '(I0)', advance='no') n
do k = 1, nCollPairs
do c = 1, interactionMatrix(k)%amount
write(fileID, '(",",I0)', advance='no') self%cells(n)%obj%tallyColl(k)%tally(c)
end do
end do
write(fileID, *)
end do
end subroutine writeCollOutput
subroutine writeEMOutput(self, fileID)
use moduleMesh
use moduleRefParam, only: L_ref, Volt_ref, B_ref, EF_ref
implicit none
class(meshParticles), intent(in):: self
integer, intent(in):: fileID
integer:: n, c
real(8):: r(1:3), Xi(1:3)
do n = 1, self%numNodes
r = self%nodes(n)%obj%getCoordinates()
if (n == self%numNodes) then
Xi = (/ 1.D0, 0.D0, 0.D0 /)
c = self%numNodes - 1
else
Xi = (/ 0.D0, 0.D0, 0.D0 /)
c = n
end if
associate(output => self%nodes(n)%obj%emData)
write(fileID, '(7(ES0.6E3,","),ES0.6E3)') r(1)*L_ref, &
output%phi*Volt_ref, &
self%cells(c)%obj%gatherElectricField(Xi)*EF_ref, &
output%B*B_ref
end associate
end do
end subroutine writeEMOutput
subroutine writeAverage(self, fileIDMean, &
fileIDDeviation, &
speciesIndex)
use moduleMesh
use moduleOutput
use moduleAverage
use moduleRefParam, only: L_ref
implicit none
class(meshParticles), intent(in):: self
integer, intent(in):: fileIDMean, fileIDDeviation
INTEGER, intent(in):: speciesIndex
real(8):: r(1:3)
type(outputFormat):: outputMean
type(outputFormat):: outputDeviation
integer:: n
do n = 1, self%numNodes
r = self%nodes(n)%obj%getCoordinates()
call calculateOutput(averageScheme(n)%mean%output(speciesIndex), outputMean, &
self%nodes(n)%obj%v, species(speciesIndex)%obj)
write(fileIDMean, '(5(ES0.6E3,","),ES0.6E3)') r(1)*L_ref, outputMean%density, outputMean%velocity, outputMean%temperature
call calculateOutput(averageScheme(n)%deviation%output(speciesIndex), outputDeviation, &
self%nodes(n)%obj%v, species(speciesIndex)%obj)
write(fileIDDeviation, '(5(ES0.6E3,","),ES0.6E3)') r(1)*L_ref, outputDeviation%density, outputDeviation%velocity, outputDeviation%temperature
end do
end subroutine writeAverage
subroutine printOutputText(self)
use moduleMesh
use moduleSpecies
use moduleMeshInoutCommon
use moduleCaseParam, ONLY: timeStep
implicit none
class(meshParticles), intent(in):: self
INTEGER:: s, fileID
character(:), allocatable:: fileName
fileID = 60
do s = 1, nSpecies
fileName = formatFileName(prefix, species(s)%obj%name, 'csv', timeStep)
write(*, "(6X,A15,A)") "Creating file: ", fileName
open (fileID, file = path // folder // '/' // fileName)
write(fileID, '(5(A,","),A)') 'Position (m)', &
'Density (m^-3)', &
'Velocity (m s^-1):0', 'Velocity (m s^-1):1', 'Velocity (m s^-1):2', &
'Temperature (K)'
call writeSpeciesOutput(self, fileID, s)
close(fileID)
end do
end subroutine printOutputText
subroutine printCollText(self)
use moduleMesh
use moduleOutput
use moduleMeshInoutCommon
use moduleCaseParam, only: timeStep
implicit none
class(meshGeneric), intent(in):: self
integer:: fileID
character(:), allocatable:: fileName
integer:: k, c
character (len=2):: cString
fileID = 62
if (collOutput) then
fileName = formatFileName(prefix, 'Collisions', 'csv', timeStep)
write(*, "(6X,A15,A)") "Creating file: ", fileName
open (fileID, file = path // folder // '/' // fileName)
write(fileID, '(A)', advance='no') "Cell"
do k = 1, nCollPairs
do c = 1, interactionMatrix(k)%amount
write(cString, "(I2)") c
write(fileID, '(",",A)', advance='no') 'Pair ' // interactionMatrix(k)%sp_i%name // '-' // interactionMatrix(k)%sp_j%name // ' collision ' // cString
end do
end do
write(fileID, *)
call writeCollOutput(self, fileID)
close(fileID)
end if
end subroutine printCollText
subroutine printEMText(self)
use moduleMesh
use moduleMeshInoutCommon
use moduleCaseParam, only: timeStep
implicit none
class(meshParticles), intent(in):: self
integer:: fileID
character(:), allocatable:: fileName
fileID = 64
if (emOutput) then
fileName = formatFileName(prefix, 'EMField', 'csv', timeStep)
write(*, "(6X,A15,A)") "Creating file: ", fileName
open (fileID, file = path // folder // '/' // fileName)
write(fileID, '(8(A,","),A)') 'Position (m)', &
'Potential (V)', &
'Electric Field (V m^-1):0', 'Electric Field (V m^-1):1', 'Electric Field (V m^-1):2', &
'Magnetic Field (T):0', 'Magnetic Field (T):1', 'Magnetic Field (T):2'
call writeEMOutput(self, fileID)
close(fileID)
end if
end subroutine printEMText
subroutine printAverageText(self)
use moduleMesh
use moduleSpecies
use moduleMeshInoutCommon
implicit none
class(meshParticles), intent(in):: self
integer:: s
integer:: fileIDMean, fileIDDeviation
character(:), allocatable:: fileNameMean, fileNameDeviation
fileIDMean = 66
fileIDDeviation = 67
do s = 1, nSpecies
fileNameMean = formatFileName('Average_mean', species(s)%obj%name, 'csv', timeStep)
write(*, "(6X,A15,A)") "Creating file: ", fileNameMean
open (fileIDMean, file = path // folder // '/' // fileNameMean)
write(fileIDMean, '(5(A,","),A)') 'Position (m)', &
'Density, mean (m^-3)', &
'Velocity, mean (m s^-1):0', 'Velocity (m s^-1):1', 'Velocity (m s^-1):2', &
'Temperature, mean (K)'
fileNameDeviation = formatFileName('Average_deviation', species(s)%obj%name, 'csv', timeStep)
write(*, "(6X,A15,A)") "Creating file: ", fileNameDeviation
open (fileIDDeviation, file = path // folder // '/' // fileNameDeviation)
write(fileIDDeviation, '(5(A,","),A)') 'Position (m)', &
'Density, deviation (m^-3)', &
'Velocity, deviation (m s^-1):0', 'Velocity (m s^-1):1', 'Velocity (m s^-1):2', &
'Temperature, deviation (K)'
call writeAverage(self, fileIDMean, fileIDDeviation, s)
close(fileIDMean)
close(fileIDDeviation)
end do
end subroutine printAverageText
end module moduleMeshOutputText

View file

@ -167,7 +167,7 @@ MODULE moduleMeshInputVTU
CLASS(meshGeneric), INTENT(inout):: self
CHARACTER(:), ALLOCATABLE, INTENT(in):: filename
REAL(8):: r(1:3) !3 generic coordinates
INTEGER:: fileID, error, found
INTEGER:: fileID
CHARACTER(LEN=256):: line
INTEGER:: numNodes, numElements, numEdges
INTEGER, ALLOCATABLE, DIMENSION(:):: entitiesID, offsets, connectivity, types
@ -275,6 +275,7 @@ MODULE moduleMeshInputVTU
END DO
!Count the number of edges
numEdges = 0
SELECT CASE(self%dimen)
CASE(3)
!Edges are triangles, type 5 in VTK
@ -547,6 +548,8 @@ MODULE moduleMeshInputVTU
CALL readDataBlock(fileID, numNodes, temperature)
REWIND(fileID)
close(fileID)
END SUBROUTINE readInitialVTU
END MODULE moduleMeshInputVTU

View file

@ -11,7 +11,7 @@ MODULE moduleMeshOutputVTU
WRITE(fileID,"(A)") '<?xml version="1.0"?>'
WRITE(fileID,"(2X, A)") '<VTKFile type="UnstructuredGrid">'
WRITE(fileID,"(4X, A,ES20.6E3,A)") '<UnstructuredGrid>'
WRITE(fileID,"(4X, A)") '<UnstructuredGrid>'
WRITE(fileID,"(6X, A, I10, A, I10, A)") '<Piece NumberOfPoints="', nNodes, '" NumberOfCells="', nCells, '">'
END SUBROUTINE writeHeader
@ -209,23 +209,22 @@ MODULE moduleMeshOutputVTU
WRITE(fileID,"(8X,A)") '<CellData>'
!Electric field
WRITE(fileID,"(10X,A, A, A)") '<DataArray type="Float64" Name="Electric Field (V m^-1)" NumberOfComponents="3">'
WRITE(fileID, "(6(ES20.6E3))") (self%cells(n)%obj%gatherElectricField(Xi)*EF_ref, n = 1, self%numCells)
WRITE(fileID,"(6(ES20.6E3))") (self%cells(n)%obj%gatherElectricField(Xi)*EF_ref, n = 1, self%numCells)
WRITE(fileID,"(10X,A)") '</DataArray>'
WRITE(fileID,"(8X,A)") '</CellData>'
END SUBROUTINE writeEM
SUBROUTINE writeCollection(fileID, t, fileNameStep, fileNameCollection)
SUBROUTINE writeCollection(fileID, fileNameStep, fileNameCollection)
USE moduleCaseParam
USE moduleOutput
USE moduleRefParam
IMPLICIT NONE
INTEGER:: fileID
INTEGER, INTENT(in):: t
CHARACTER(*):: fileNameStep, fileNameCollection
IF (t == tInitial) THEN
IF (timeStep == tInitial) THEN
!Create collection file
WRITE(*, "(6X,A15,A)") "Creating file: ", fileNameCollection
OPEN (fileID + 1, file = path // folder // '/' // fileNameCollection)
@ -237,10 +236,11 @@ MODULE moduleMeshOutputVTU
!Write iteration file in collection
OPEN (fileID + 1, file = path // folder // '/' // fileNameCollection, ACCESS='APPEND')
WRITE(fileID + 1, "(4X, A, ES20.6E3, A, A, A)") '<DataSet timestep="', DBLE(t)*tauMin*ti_ref,'" file="', fileNameStep,'"/>'
WRITE(fileID + 1, "(4X, A, ES20.6E3, A, A, A)") &
'<DataSet timestep="', DBLE(timeStep)*tauMin*ti_ref,'" file="', fileNameStep,'"/>'
!Close collection file
IF (t == tFinal) THEN
IF (timeStep == tFinal) THEN
WRITE (fileID + 1, "(2X, A)") '</Collection>'
WRITE (fileID + 1, "(A)") '</VTKFile>'
@ -307,22 +307,21 @@ MODULE moduleMeshOutputVTU
END SUBROUTINE writeAverage
SUBROUTINE printOutputVTU(self,t)
SUBROUTINE printOutputVTU(self)
USE moduleMesh
USE moduleSpecies
USE moduleMeshInoutCommon
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
CLASS(meshParticles), INTENT(in):: self
INTEGER, INTENT(in):: t
INTEGER:: n, i, fileID
INTEGER:: i, fileID
CHARACTER(:), ALLOCATABLE:: fileName, fileNameCollection
TYPE(outputFormat):: output(1:self%numNodes)
fileID = 60
DO i = 1, nSpecies
fileName = formatFileName(prefix, species(i)%obj%name, 'vtu', t)
fileName = formatFileName(prefix, species(i)%obj%name, 'vtu', timeStep)
WRITE(*, "(6X,A15,A)") "Creating file: ", fileName
OPEN (fileID, file = path // folder // '/' // fileName)
@ -338,29 +337,27 @@ MODULE moduleMeshOutputVTU
!Write collection file for time plotting
fileNameCollection = formatFileName('Collection', species(i)%obj%name, 'pvd')
CALL writeCollection(fileID, t, fileName, filenameCollection)
CALL writeCollection(fileID, fileName, filenameCollection)
END DO
END SUBROUTINE printOutputVTU
SUBROUTINE printCollVTU(self,t)
SUBROUTINE printCollVTU(self)
USE moduleMesh
USE moduleOutput
USE moduleMeshInoutCommon
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
CLASS(meshGeneric), INTENT(in):: self
INTEGER, INTENT(in):: t
INTEGER:: n, i, fileID
INTEGER:: fileID
CHARACTER(:), ALLOCATABLE:: fileName, fileNameCollection
CHARACTER (LEN=iterationDigits):: tstring
TYPE(outputFormat):: output(1:self%numNodes)
fileID = 62
IF (collOutput) THEN
fileName = formatFileName(prefix, 'Collisions', 'vtu', t)
fileName = formatFileName(prefix, 'Collisions', 'vtu', timeStep)
WRITE(*, "(6X,A15,A)") "Creating file: ", fileName
OPEN (fileID, file = path // folder // '/' // fileName)
@ -376,26 +373,26 @@ MODULE moduleMeshOutputVTU
!Write collection file for time plotting
fileNameCollection = formatFileName('Collection', 'Collisions', 'pvd')
CALL writeCollection(fileID, t, fileName, filenameCollection)
CALL writeCollection(fileID, fileName, filenameCollection)
END IF
END SUBROUTINE printCollVTU
SUBROUTINE printEMVTU(self, t)
SUBROUTINE printEMVTU(self)
USE moduleMesh
USE moduleMeshInoutCommon
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
CLASS(meshParticles), INTENT(in):: self
INTEGER, INTENT(in):: t
INTEGER:: fileID
CHARACTER(:), ALLOCATABLE:: fileName, fileNameCollection
fileID = 64
IF (emOutput) THEN
fileName = formatFileName(prefix, 'EMField', 'vtu', t)
fileName = formatFileName(prefix, 'EMField', 'vtu', timeStep)
WRITE(*, "(6X,A15,A)") "Creating file: ", fileName
OPEN (fileID, file = path // folder // '/' // fileName)
@ -411,7 +408,7 @@ MODULE moduleMeshOutputVTU
!Write collection file for time plotting
fileNameCollection = formatFileName('Collection', 'EMField', 'pvd')
CALL writeCollection(fileID, t, fileName, filenameCollection)
CALL writeCollection(fileID, fileName, filenameCollection)
END IF
@ -424,9 +421,8 @@ MODULE moduleMeshOutputVTU
IMPLICIT NONE
CLASS(meshParticles), INTENT(in):: self
INTEGER:: n, i, fileIDMean, fileIDDeviation
INTEGER:: i, fileIDMean, fileIDDeviation
CHARACTER(:), ALLOCATABLE:: fileNameMean, fileNameDeviation
TYPE(outputFormat):: output(1:self%numNodes)
fileIDMean = 66
fileIDDeviation = 67

View file

@ -59,6 +59,13 @@ MODULE moduleMesh
END TYPE meshNodeCont
! Array of pointers to nodes.
TYPE:: meshNodePointer
CLASS(meshNode), POINTER:: obj
CONTAINS
END TYPE meshNodePointer
!Type for array of boundary functions (one per species)
TYPE, PUBLIC:: fBoundaryGeneric
PROCEDURE(boundary_interface), POINTER, NOPASS:: apply => NULL()
@ -76,8 +83,8 @@ MODULE moduleMesh
CLASS(meshCell), POINTER:: eColl => NULL()
!Normal vector
REAL(8):: normal(1:3)
!Weight for random injection of particles
REAL(8):: weight = 1.D0
! Surface of edge
REAL(8):: surface = 0.D0
!Pointer to boundary type
TYPE(boundaryCont), POINTER:: boundary
!Array of functions for boundary conditions
@ -372,10 +379,9 @@ MODULE moduleMesh
END SUBROUTINE connectMesh_interface
!Prints number of collisions in each cell
SUBROUTINE printColl_interface(self, t)
SUBROUTINE printColl_interface(self)
IMPORT meshGeneric
CLASS(meshGeneric), INTENT(in):: self
INTEGER, INTENT(in):: t
END SUBROUTINE printColl_interface
@ -403,18 +409,16 @@ MODULE moduleMesh
ABSTRACT INTERFACE
!Prints Species data
SUBROUTINE printOutput_interface(self, t)
SUBROUTINE printOutput_interface(self)
IMPORT meshParticles
CLASS(meshParticles), INTENT(in):: self
INTEGER, INTENT(in):: t
END SUBROUTINE printOutput_interface
!Prints EM info
SUBROUTINE printEM_interface(self, t)
SUBROUTINE printEM_interface(self)
IMPORT meshParticles
CLASS(meshParticles), INTENT(in):: self
INTEGER, INTENT(in):: t
END SUBROUTINE printEM_interface
@ -495,18 +499,17 @@ MODULE moduleMesh
IMPLICIT NONE
CLASS(meshParticles), INTENT(inout):: self
INTEGER:: e
INTEGER:: nNodes
INTEGER:: c
INTEGER, ALLOCATABLE:: n(:)
REAL(8), ALLOCATABLE:: localK(:,:)
INTEGER:: i, j
DO e = 1, self%numCells
nNodes = self%cells(e)%obj%nNodes
DO c = 1, self%numCells
associate(nNodes => self%cells(c)%obj%nNodes)
ALLOCATE(n(1:nNodes))
ALLOCATE(localK(1:nNodes, 1:nNodes))
n = self%cells(e)%obj%getNodes(nNodes)
localK = self%cells(e)%obj%elemK(nNodes)
n = self%cells(c)%obj%getNodes(nNodes)
localK = self%cells(c)%obj%elemK(nNodes)
DO i = 1, nNodes
DO j = 1, nNodes
@ -518,6 +521,8 @@ MODULE moduleMesh
DEALLOCATE(n, localK)
end associate
END DO
END SUBROUTINE constructGlobalK
@ -613,6 +618,7 @@ MODULE moduleMesh
INTEGER:: sp
INTEGER:: i
CLASS(meshNode), POINTER:: node
REAL(8):: pFraction !Particle fraction
cellNodes = self%getNodes(nNodes)
fPsi = self%fPsi(part%Xi, nNodes)
@ -623,10 +629,11 @@ MODULE moduleMesh
DO i = 1, nNodes
node => mesh%nodes(cellNodes(i))%obj
pFraction = fPsi(i)*part%weight
CALL OMP_SET_LOCK(node%lock)
node%output(sp)%den = node%output(sp)%den + part%weight*fPsi(i)
node%output(sp)%mom(:) = node%output(sp)%mom(:) + part%weight*fPsi(i)*part%v(:)
node%output(sp)%tensorS(:,:) = node%output(sp)%tensorS(:,:) + part%weight*fPsi(i)*tensorS
node%output(sp)%den = node%output(sp)%den + pFraction
node%output(sp)%mom(:) = node%output(sp)%mom(:) + pFraction*part%v(:)
node%output(sp)%tensorS(:,:) = node%output(sp)%tensorS(:,:) + pFraction*tensorS
CALL OMP_UNSET_LOCK(node%lock)
END DO
@ -787,7 +794,7 @@ MODULE moduleMesh
END FUNCTION findCellBrute
!Computes collisions in element
SUBROUTINE doCollisions(self, t)
SUBROUTINE doCollisions(self)
USE moduleCollisions
USE moduleSpecies
USE moduleList
@ -795,10 +802,10 @@ MODULE moduleMesh
USE moduleRandom
USE moduleOutput
USE moduleMath
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
CLASS(meshGeneric), INTENT(inout), TARGET:: self
INTEGER, INTENT(in):: t
INTEGER:: e
CLASS(meshCell), POINTER:: cell
INTEGER:: k, i, j
@ -814,7 +821,7 @@ MODULE moduleMesh
REAL(8):: rnd_real !Random number for collision
INTEGER:: rnd_int !Random number for collision
IF (MOD(t, everyColl) == 0) THEN
IF (MOD(timeStep, everyColl) == 0) THEN
!Collisions need to be performed in this iteration
!$OMP DO SCHEDULE(DYNAMIC) PRIVATE(part_i, part_j, partTemp_i, partTemp_j)
DO e=1, self%numCells
@ -911,7 +918,9 @@ MODULE moduleMesh
!Loop over collisions
DO c = 1, interactionMatrix(k)%amount
IF (rnd_real <= probabilityColl(c)) THEN
!$OMP CRITICAL
CALL interactionMatrix(k)%collisions(c)%obj%collide(part_i, part_j, vRel)
!$OMP END CRITICAL
!If collisions are gonna be output, count the collision
IF (collOutput) THEN
@ -1021,6 +1030,9 @@ MODULE moduleMesh
ALLOCATE(deltaV_ij(1:cell%listPart_in(i)%amount, 1:3))
ALLOCATE(p_ij(1:cell%listPart_in(i)%amount, 1:3))
ALLOCATE(mass_ij(1:cell%listPart_in(i)%amount))
deltaV_ij = 0.D0
p_ij = 0.D0
mass_ij = 0.D0
!Loop over particles of species_i
partTemp => cell%listPart_in(i)%head
p = 1
@ -1105,6 +1117,9 @@ MODULE moduleMesh
ALLOCATE(deltaV_ji(1:cell%listPart_in(j)%amount, 1:3))
ALLOCATE(p_ji(1:cell%listPart_in(j)%amount, 1:3))
ALLOCATE(mass_ji(1:cell%listPart_in(j)%amount))
deltaV_ji = 0.D0
p_ji = 0.D0
mass_ji = 0.D0
!Loop over particles of species_j
partTemp => cell%listPart_in(j)%head
p = 1

View file

@ -77,6 +77,20 @@ MODULE moduleMeshBoundary
END SUBROUTINE transparent
!Symmetry axis. Reflects particles.
!Although this function should never be called, it is set as a reflective boundary
!to properly deal with possible particles reaching a corner and selecting this boundary.
SUBROUTINE symmetryAxis(edge, part)
USE moduleSpecies
IMPLICIT NONE
CLASS(meshEdge), INTENT(inout):: edge
CLASS(particle), INTENT(inout):: part
CALL reflection(edge, part)
END SUBROUTINE symmetryAxis
!Wall with temperature
SUBROUTINE wallTemperature(edge, part)
USE moduleSpecies
@ -147,7 +161,13 @@ MODULE moduleMeshBoundary
ALLOCATE(newElectron)
ALLOCATE(newIon)
IF (ASSOCIATED(bound%electronSecondary)) THEN
newElectron%species => bound%electronSecondary
ELSE
newElectron%species => part%species
END IF
newIon%species => bound%species
newElectron%v = v0 + (1.D0 + bound%deltaV*v0/NORM2(v0))
@ -198,19 +218,27 @@ MODULE moduleMeshBoundary
END SUBROUTINE ionization
!Symmetry axis. Reflects particles.
!Although this function should never be called, it is set as a reflective boundary
!to properly deal with possible particles reaching a corner and selecting this boundary.
SUBROUTINE symmetryAxis(edge, part)
USE moduleSpecies
IMPLICIT NONE
subroutine outflowAdaptive(edge, part)
use moduleRandom
implicit none
CLASS(meshEdge), INTENT(inout):: edge
CLASS(particle), INTENT(inout):: part
class(meshEdge), intent(inout):: edge
class(particle), intent(inout):: part
CALL reflection(edge, part)
select type(bound => edge%boundary%bTypes(part%species%n)%obj)
type is(boundaryOutflowAdaptive)
END SUBROUTINE symmetryAxis
if (random() < 0.844d0) then
call reflection(edge, part)
else
call transparent(edge, part)
end if
end select
end subroutine outflowAdaptive
!Points the boundary function to specific type
SUBROUTINE pointBoundaryFunction(edge, s)
@ -230,14 +258,17 @@ MODULE moduleMeshBoundary
TYPE IS(boundaryTransparent)
edge%fBoundary(s)%apply => transparent
TYPE IS(boundaryAxis)
edge%fBoundary(s)%apply => symmetryAxis
TYPE IS(boundaryWallTemperature)
edge%fBoundary(s)%apply => wallTemperature
TYPE IS(boundaryIonization)
edge%fBoundary(s)%apply => ionization
TYPE IS(boundaryAxis)
edge%fBoundary(s)%apply => symmetryAxis
type is(boundaryOutflowAdaptive)
edge%fBoundary(s)%apply => outflowAdaptive
CLASS DEFAULT
CALL criticalError("Boundary type not defined in this geometry", 'pointBoundaryFunction')

View file

@ -26,6 +26,12 @@ MODULE moduleBoundary
END TYPE boundaryTransparent
!Symmetry axis
TYPE, PUBLIC, EXTENDS(boundaryGeneric):: boundaryAxis
CONTAINS
END TYPE boundaryAxis
!Wall Temperature boundary
TYPE, PUBLIC, EXTENDS(boundaryGeneric):: boundaryWallTemperature
!Thermal velocity of the wall: square root(Wall temperature X specific heat)
@ -38,6 +44,7 @@ MODULE moduleBoundary
TYPE, PUBLIC, EXTENDS(boundaryGeneric):: boundaryIonization
REAL(8):: m0, n0, v0(1:3), vTh !Properties of background neutrals.
CLASS(speciesGeneric), POINTER:: species !Ion species
CLASS(speciesCharged), POINTER:: electronSecondary !Pointer to species considerer as secondary electron
TYPE(table1D):: crossSection
REAL(8):: effectiveTime
REAL(8):: eThreshold
@ -46,11 +53,13 @@ MODULE moduleBoundary
END TYPE boundaryIonization
!Symmetry axis
TYPE, PUBLIC, EXTENDS(boundaryGeneric):: boundaryAxis
CONTAINS
!Boundary for quasi-neutral outflow adjusting reflection coefficient
type, public, extends(boundaryGeneric):: boundaryOutflowAdaptive
real(8):: outflowCurrent
real(8):: reflectionFraction
contains
END TYPE boundaryAxis
end type boundaryOutflowAdaptive
!Wrapper for boundary types (one per species)
TYPE:: bTypesCont
@ -103,17 +112,19 @@ MODULE moduleBoundary
END SUBROUTINE initWallTemperature
SUBROUTINE initIonization(boundary, me, m0, n0, v0, T0, speciesID, effTime, crossSection, eThreshold)
SUBROUTINE initIonization(boundary, me, m0, n0, v0, T0, ion, effTime, crossSection, eThreshold, electronSecondary)
USE moduleRefParam
USE moduleSpecies
USE moduleCaseParam
USE moduleConstParam
USE moduleErrors
IMPLICIT NONE
CLASS(boundaryGeneric), ALLOCATABLE, INTENT(out):: boundary
REAL(8), INTENT(in):: me !Electron mass
REAL(8), INTENT(in):: m0, n0, v0(1:3), T0 !Neutral properties
INTEGER:: speciesID
INTEGER, INTENT(in):: ion
INTEGER, OPTIONAL, INTENT(in):: electronSecondary
REAL(8):: effTime
CHARACTER(:), ALLOCATABLE, INTENT(in):: crossSection
REAL(8), INTENT(in):: eThreshold
@ -126,7 +137,22 @@ MODULE moduleBoundary
boundary%n0 = n0 * Vol_ref
boundary%v0 = v0 / v_ref
boundary%vTh = DSQRT(kb*T0/m0)/v_ref
boundary%species => species(speciesID)%obj
boundary%species => species(ion)%obj
IF (PRESENT(electronSecondary)) THEN
SELECT TYPE(sp => species(electronSecondary)%obj)
TYPE IS(speciesCharged)
boundary%electronSecondary => sp
CLASS DEFAULT
CALL criticalError("Species " // sp%name // " chosen for " // &
"secondary electron is not a charged species", 'initIonization')
END SELECT
ELSE
boundary%electronSecondary => NULL()
END IF
boundary%effectiveTime = effTime / ti_ref
CALL boundary%crossSection%init(crossSection)
CALL boundary%crossSection%convert(eV2J/(m_ref*v_ref**2), 1.D0/L_ref**2)

View file

@ -44,6 +44,7 @@ MODULE moduleCollisions
REAL(8):: eThreshold !Minimum energy (non-dimensional units) required for ionization
REAL(8):: deltaV !Change in velocity due to exchange of eThreshold
CLASS(speciesCharged), POINTER:: electron !Pointer to species considerer as electrons
CLASS(speciesCharged), POINTER:: electronSecondary !Pointer to species considerer as secondary electron
CONTAINS
PROCEDURE, PASS:: collide => collideBinaryIonization
@ -241,7 +242,7 @@ MODULE moduleCollisions
!ELECTRON IMPACT IONIZATION
!Inits electron impact ionization
SUBROUTINE initBinaryIonization(collision, crossSectionFilename, energyThreshold, electron)
SUBROUTINE initBinaryIonization(collision, crossSectionFilename, energyThreshold, electron, electronSecondary)
USE moduleTable
USE moduleRefParam
USE moduleConstParam
@ -253,7 +254,8 @@ MODULE moduleCollisions
CHARACTER(:), ALLOCATABLE, INTENT(in):: crossSectionFilename
REAL(8), INTENT(in):: energyThreshold
CHARACTER(:), ALLOCATABLE, INTENT(in):: electron
INTEGER:: electronIndex
CHARACTER(:), ALLOCATABLE, OPTIONAL, INTENT(in):: electronSecondary
INTEGER:: electronIndex, electronSecondaryIndex
ALLOCATE(collisionBinaryIonization:: collision)
@ -276,12 +278,29 @@ MODULE moduleCollisions
TYPE IS(speciesCharged)
collision%electron => sp
CLASS DEFAULT
CALL criticalError("Species " // sp%name // " chosen for " // &
"impacting electron is not a charged species", 'initBinaryIonization')
END SELECT
IF (PRESENT(electronSecondary)) THEN
electronSecondaryIndex = speciesName2Index(electronSecondary)
SELECT TYPE(sp => species(electronSecondaryIndex)%obj)
TYPE IS(speciesCharged)
collision%electronSecondary => sp
CLASS DEFAULT
CALL criticalError("Species " // sp%name // " chosen for " // &
"secondary electron is not a charged species", 'initBinaryIonization')
END SELECT
ELSE
collision%electronSecondary => NULL()
END IF
!momentum change per ionization process
collision%deltaV = sqrt(collision%eThreshold / collision%electron%m)
@ -336,6 +355,12 @@ MODULE moduleCollisions
!Copy basic information from primary electron
newElectron = electron
!If secondary electron species indicates, convert
IF (ASSOCIATED(self%electronSecondary)) THEN
newElectron%species => self%electronSecondary
END IF
!Secondary electorn gains energy from ionization
newElectron%v = vChange
@ -362,7 +387,7 @@ MODULE moduleCollisions
CALL sp%ionize(neutral)
CLASS DEFAULT
! CALL criticalError(sp%name // " is not a neutral", 'collideBinaryIonization')
CALL criticalError(sp%name // " is not a neutral", 'collideBinaryIonization')
RETURN
END SELECT

View file

@ -54,15 +54,16 @@ MODULE moduleInject
INTEGER:: id
CHARACTER(:), ALLOCATABLE:: name
REAL(8):: vMod !Velocity (module)
REAL(8):: T(1:3) !Temperature
REAL(8):: temperature(1:3) !Temperature
REAL(8):: n(1:3) !Direction of injection
LOGICAL:: fixDirection !The injection of particles has a fix direction defined by n
INTEGER:: nParticles !Number of particles to introduce each time step
CLASS(speciesGeneric), POINTER:: species !Species of injection
INTEGER:: nEdges
INTEGER, ALLOCATABLE:: edges(:) !Array with edges
REAL(8), ALLOCATABLE:: cumWeight(:) !Array of cummulative probability
REAL(8):: sumWeight
INTEGER, ALLOCATABLE:: particlesPerEdge(:) ! Particles per edge
REAL(8), ALLOCATABLE:: weightPerEdge(:) ! Weight per edge
REAL(8):: surface ! Total surface of injection
TYPE(velDistCont):: v(1:3) !Velocity distribution function in each direction
CONTAINS
PROCEDURE, PASS:: init => initInject
@ -75,7 +76,7 @@ MODULE moduleInject
CONTAINS
!Initialize an injection of particles
SUBROUTINE initInject(self, i, v, n, T, flow, units, sp, physicalSurface)
SUBROUTINE initInject(self, i, v, n, temperature, flow, units, sp, physicalSurface, particlesPerEdge)
USE moduleMesh
USE moduleRefParam
USE moduleConstParam
@ -86,49 +87,29 @@ MODULE moduleInject
CLASS(injectGeneric), INTENT(inout):: self
INTEGER, INTENT(in):: i
REAL(8), INTENT(in):: v, n(1:3), T(1:3)
INTEGER, INTENT(in):: sp, physicalSurface
REAL(8), INTENT(in):: v, n(1:3), temperature(1:3)
INTEGER, INTENT(in):: sp, physicalSurface, particlesPerEdge
REAL(8):: tauInject
REAL(8), INTENT(in):: flow
CHARACTER(:), ALLOCATABLE, INTENT(in):: units
INTEGER:: e, et
INTEGER:: phSurface(1:mesh%numEdges)
INTEGER:: nVolColl
REAL(8):: fluxPerStep = 0.D0
self%id = i
self%vMod = v / v_ref
self%n = n / NORM2(n)
self%T = T / T_ref
self%species => species(sp)%obj
tauInject = tau(self%species%n)
SELECT CASE(units)
CASE ("sccm")
!Standard cubic centimeter per minute
self%nParticles = INT(flow*sccm2atomPerS*tauInject*ti_ref/species(sp)%obj%weight)
CASE ("A")
!Input current in Ampers
self%nParticles = INT(flow*tauInject*ti_ref/(qe*species(sp)%obj%weight))
CASE ("part/s")
!Input current in Ampers
self%nParticles = INT(flow*tauInject*ti_ref/species(sp)%obj%weight)
CASE DEFAULT
CALL criticalError("No support for units: " // units, 'initInject')
END SELECT
!Scale particles for different species steps
IF (self%nParticles == 0) CALL criticalError("The number of particles for inject is 0.", 'initInject')
self%temperature = temperature / T_ref
!Gets the edge elements from which particles are injected
DO e = 1, mesh%numEdges
phSurface(e) = mesh%edges(e)%obj%physicalSurface
END DO
self%nEdges = COUNT(phSurface == physicalSurface)
ALLOCATE(inject(i)%edges(1:self%nEdges))
ALLOCATE(self%edges(1:self%nEdges))
ALLOCATE(self%particlesPerEdge(1:self%nEdges))
ALLOCATE(self%weightPerEdge(1:self%nEdges))
et = 0
DO e=1, mesh%numEdges
IF (mesh%edges(e)%obj%physicalSurface == physicalSurface) THEN
@ -160,15 +141,82 @@ MODULE moduleInject
END DO
!Calculates cumulative probability
ALLOCATE(self%cumWeight(1:self%nEdges))
et = 1
self%cumWeight(1) = mesh%edges(self%edges(et))%obj%weight
DO et = 2, self%nEdges
self%cumWeight(et) = mesh%edges(self%edges(et))%obj%weight + self%cumWeight(et-1)
!Calculates total area
self%surface = 0.D0
DO et = 1, self%nEdges
self%surface = self%surface + mesh%edges(self%edges(et))%obj%surface
END DO
self%sumWeight = self%cumWeight(self%nEdges)
! Information about species and flux
self%species => species(sp)%obj
tauInject = tau(self%species%n)
! Convert units
SELECT CASE(units)
CASE ("sccm")
!Standard cubic centimeter per minute
fluxPerStep = flow*sccm2atomPerS
CASE ("A")
!Current in Ampers
SELECT TYPE(sp => self%species)
CLASS IS(speciesCharged)
fluxPerStep = flow/(qe*abs(sp%q))
CLASS DEFAULT
call criticalError('Attempted to assign a flux in "A" to a species without charge.', 'initInject')
END SELECT
CASE ("Am2")
!Input current in Ampers per square meter
SELECT TYPE(sp => self%species)
CLASS IS(speciesCharged)
fluxPerStep = flow*self%surface*L_ref**2/(qe*abs(sp%q))
CLASS DEFAULT
call criticalError('Attempted to assign a flux in "Am2" to a species without charge.', 'initInject')
END SELECT
CASE ("part/s")
!Input current in Ampers
fluxPerStep = flow
CASE DEFAULT
CALL criticalError("No support for units: " // units, 'initInject')
END SELECT
fluxPerStep = fluxPerStep * tauInject * ti_ref / self%surface
!Assign particles per edge
IF (particlesPerEdge > 0) THEN
! Particles per edge defined by the user
self%particlesPerEdge = particlesPerEdge
DO et = 1, self%nEdges
self%weightPerEdge(et) = fluxPerStep*mesh%edges(self%edges(et))%obj%surface / REAL(particlesPerEdge)
END DO
self%nParticles = SUM(self%particlesPerEdge)
ELSE
! No particles assigned per edge, use the species weight
self%weightPerEdge = self%species%weight
DO et = 1, self%nEdges
self%particlesPerEdge(et) = max(1,FLOOR(fluxPerStep*mesh%edges(self%edges(et))%obj%surface / self%species%weight))
END DO
self%nParticles = SUM(self%particlesPerEdge)
!Rescale weight to match flux
self%weightPerEdge = fluxPerStep * self%surface / (real(self%nParticles))
END IF
!Scale particles for different species steps
IF (self%nParticles == 0) CALL criticalError("The number of particles for inject is 0.", 'initInject')
END SUBROUTINE initInject
@ -203,23 +251,23 @@ MODULE moduleInject
END SUBROUTINE doInjects
SUBROUTINE initVelDistMaxwellian(velDist, T, m)
SUBROUTINE initVelDistMaxwellian(velDist, temperature, m)
IMPLICIT NONE
CLASS(velDistGeneric), ALLOCATABLE, INTENT(out):: velDist
REAL(8), INTENT(in):: T, m
REAL(8), INTENT(in):: temperature, m
velDist = velDistMaxwellian(vTh = DSQRT(T/m))
velDist = velDistMaxwellian(vTh = DSQRT(2.d0*temperature/m))
END SUBROUTINE initVelDistMaxwellian
SUBROUTINE initVelDistHalfMaxwellian(velDist, T, m)
SUBROUTINE initVelDistHalfMaxwellian(velDist, temperature, m)
IMPLICIT NONE
CLASS(velDistGeneric), ALLOCATABLE, INTENT(out):: velDist
REAL(8), INTENT(in):: T, m
REAL(8), INTENT(in):: temperature, m
velDist = velDistHalfMaxwellian(vTh = DSQRT(T/m))
velDist = velDistHalfMaxwellian(vTh = DSQRT(2.d0*temperature/m))
END SUBROUTINE initVelDistHalfMaxwellian
@ -241,7 +289,7 @@ MODULE moduleInject
REAL(8):: v
v = 0.D0
v = self%vTh*randomMaxwellian()
v = self%vTh*randomMaxwellian()/sqrt(2.d0)
END FUNCTION randomVelMaxwellian
@ -254,10 +302,7 @@ MODULE moduleInject
REAL(8):: v
v = 0.D0
DO WHILE (v <= 0.D0)
v = self%vTh*randomMaxwellian()
END DO
v = self%vTh*randomHalfMaxwellian()/sqrt(2.d0)
END FUNCTION randomVelHalfMaxwellian
@ -282,9 +327,8 @@ MODULE moduleInject
IMPLICIT NONE
CLASS(injectGeneric), INTENT(in):: self
INTEGER:: randomX
INTEGER, SAVE:: nMin, nMax !Min and Max index in partInj array
INTEGER:: i
INTEGER, SAVE:: nMin
INTEGER:: i, e
INTEGER:: n, sp
CLASS(meshEdge), POINTER:: randomEdge
REAL(8):: direction(1:3)
@ -299,22 +343,23 @@ MODULE moduleInject
END IF
END DO
nMin = nMin + 1
nMax = nMin + self%nParticles - 1
!Assign weight to particle.
partInj(nMin:nMax)%weight = self%species%weight
!Particle is considered to be outside the domain
partInj(nMin:nMax)%n_in = .FALSE.
!$OMP END SINGLE
!$OMP DO
DO n = nMin, nMax
randomX = randomWeighted(self%cumWeight, self%sumWeight)
randomEdge => mesh%edges(self%edges(randomX))%obj
DO e = 1, self%nEdges
! Select edge for injection
randomEdge => mesh%edges(self%edges(e))%obj
! Inject particles in edge
DO i = 1, self%particlesPerEdge(e)
! Index in the global partInj array
n = nMin - 1 + SUM(self%particlesPerEdge(1:e-1)) + i
!Particle is considered to be outside the domain
partInj(n)%n_in = .FALSE.
!Random position in edge
partInj(n)%r = randomEdge%randPos()
!Assign weight to particle.
partInj(n)%weight = self%weightPerEdge(e)
!Volume associated to the edge:
IF (ASSOCIATED(randomEdge%e1)) THEN
partInj(n)%cell = randomEdge%e1%n
@ -332,19 +377,22 @@ MODULE moduleInject
!Assign particle type
partInj(n)%species => self%species
if (all(self%n == 0.D0)) then
direction = randomEdge%normal
else
direction = self%n
end if
partInj(n)%v = 0.D0
do while(dot_product(partInj(n)%v, direction) <= 0.d0)
partInj(n)%v = self%vMod*direction + (/ self%v(1)%obj%randomVel(), &
self%v(2)%obj%randomVel(), &
self%v(3)%obj%randomVel() /)
end do
!If velocity is not in the right direction, invert it
IF (DOT_PRODUCT(direction, partInj(n)%v) < 0.D0) THEN
partInj(n)%v = - partInj(n)%v
END IF
!Obtain natural coordinates of particle in cell
partInj(n)%Xi = mesh%cells(partInj(n)%cell)%obj%phy2log(partInj(n)%r)
@ -354,6 +402,8 @@ MODULE moduleInject
CALL solver%updateParticleCell(partInj(n))
END DO
END DO
!$OMP END DO
END SUBROUTINE addParticles

View file

@ -27,7 +27,7 @@ MODULE moduleProbe
CONTAINS
!Functions for probeDistFunc type
SUBROUTINE init(self, id, speciesName, r, v1, v2, v3, points, timeStep)
SUBROUTINE init(self, id, speciesName, r, v1, v2, v3, points, everyTimeStep)
USE moduleCaseParam
USE moduleRefParam
USE moduleSpecies
@ -41,7 +41,7 @@ MODULE moduleProbe
REAL(8), INTENT(in):: r(1:3)
REAL(8), INTENT(in):: v1(1:2), v2(1:2), v3(1:2)
INTEGER, INTENT(in):: points(1:3)
REAL(8), INTENT(in):: timeStep
REAL(8), INTENT(in):: everyTimeStep
INTEGER:: sp, i
REAL(8):: dv(1:3)
@ -91,17 +91,17 @@ MODULE moduleProbe
1:self%nv(3)))
!Number of iterations between output
IF (timeStep == 0.D0) THEN
IF (everyTimeStep == 0.D0) THEN
self%every = 1
ELSE
self%every = NINT(timeStep/ tauMin / ti_ref)
self%every = NINT(everyTimeStep/ tauMin / ti_ref)
END IF
!Maximum radius
!TODO: Make this an input parameter
self%maxR = 1.D0
self%maxR = 1.D-2/L_ref
!Init the probe lock
CALL OMP_INIT_LOCK(self%lock)
@ -148,7 +148,7 @@ MODULE moduleProbe
deltaR = NORM2(self%r - part%r)
!Only include particle if it is inside the maximum radius
IF (deltaR < self%maxR) THEN
! IF (deltaR < self%maxR) THEN
!find lower index for all dimensions
CALL self%findLowerIndex(part%v, i, j, k, inside)
@ -162,40 +162,40 @@ MODULE moduleProbe
fk = self%vk(k+1) - part%v(3)
fk1 = part%v(3) - self%vk(k)
! weight = part%weight * DEXP(deltaR/self%maxR)
weight = part%weight
weight = part%weight * DEXP(-deltaR/self%maxR)
! weight = part%weight
!Lock the probe
CALL OMP_SET_LOCK(self%lock)
!Assign particle weight to distribution function
self%f(i , j , k ) = fi * fj * fk * weight
self%f(i+1, j , k ) = fi1 * fj * fk * weight
self%f(i , j+1, k ) = fi * fj1 * fk * weight
self%f(i+1, j+1, k ) = fi1 * fj1 * fk * weight
self%f(i , j , k+1) = fi * fj * fk1 * weight
self%f(i+1, j , k+1) = fi1 * fj * fk1 * weight
self%f(i , j+1, k+1) = fi * fj1 * fk1 * weight
self%f(i+1, j+1, k+1) = fi1 * fj1 * fk1 * weight
self%f(i , j , k ) = self%f(i , j , k ) + fi * fj * fk * weight
self%f(i+1, j , k ) = self%f(i+1, j , k ) + fi1 * fj * fk * weight
self%f(i , j+1, k ) = self%f(i , j+1, k ) + fi * fj1 * fk * weight
self%f(i+1, j+1, k ) = self%f(i+1, j+1, k ) + fi1 * fj1 * fk * weight
self%f(i , j , k+1) = self%f(i , j , k+1) + fi * fj * fk1 * weight
self%f(i+1, j , k+1) = self%f(i+1, j , k+1) + fi1 * fj * fk1 * weight
self%f(i , j+1, k+1) = self%f(i , j+1, k+1) + fi * fj1 * fk1 * weight
self%f(i+1, j+1, k+1) = self%f(i+1, j+1, k+1) + fi1 * fj1 * fk1 * weight
!Unlock the probe
CALL OMP_UNSET_LOCK(self%lock)
END IF
END IF
! END IF
END IF
END SUBROUTINE calculate
SUBROUTINE output(self, t)
SUBROUTINE output(self)
USE moduleOutput
USE moduleRefParam
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
CLASS(probeDistFunc), INTENT(inout):: self
INTEGER, INTENT(in):: t
CHARACTER (LEN=iterationDigits):: tstring
CHARACTER (LEN=3):: pstring
CHARACTER(:), ALLOCATABLE:: filename
@ -204,14 +204,14 @@ MODULE moduleProbe
!Divide by the velocity cube volume
self%f = self%f * self%dvInv
WRITE(tstring, iterationFormat) t
WRITE(tstring, iterationFormat) timeStep
WRITE(pstring, "(I3.3)") self%id
fileName='Probe_' // tstring// '_f_' // pstring // '.dat'
WRITE(*, "(6X,A15,A)") "Creating file: ", fileName
OPEN (10, file = path // folder // '/' // fileName)
WRITE(10, "(A1, 1X, A)") "# ", self%species%name
WRITE(10, "(A6, 3(ES15.6E3), A2)") "# r = ", self%r(:)*L_ref, " m"
WRITE(10, "(A6, ES15.6E3, A2)") "# t = ", REAL(t)*tauMin*ti_ref, " s"
WRITE(10, "(A6, ES15.6E3, A2)") "# t = ", REAL(timeStep)*tauMin*ti_ref, " s"
WRITE(10, "(A1, A19, 3(A20))") "#", "v1 (m s^-1)", "v2 (m s^-1)", "v3 (m s^-1)", "f"
DO i = 1, self%nv(1)
DO j = 1, self%nv(2)
@ -252,15 +252,15 @@ MODULE moduleProbe
END SUBROUTINE doProbes
SUBROUTINE outputProbes(t)
SUBROUTINE outputProbes()
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
INTEGER, INTENT(in):: t
INTEGER:: i
DO i = 1, nProbes
IF (probe(i)%update) THEN
CALL probe(i)%output(t)
CALL probe(i)%output()
END IF
@ -268,15 +268,15 @@ MODULE moduleProbe
END SUBROUTINE outputProbes
SUBROUTINE resetProbes(t)
SUBROUTINE resetProbes()
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
INTEGER, INTENT(in):: t
INTEGER:: i
DO i = 1, nProbes
probe(i)%f = 0.D0
probe(i)%update = t == tFinal .OR. t == tInitial .OR. MOD(t, probe(i)%every) == 0
probe(i)%update = timeStep == tFinal .OR. timeStep == tInitial .OR. MOD(timeStep, probe(i)%every) == 0
END DO

View file

@ -22,7 +22,6 @@ MODULE moduleOutput
!Type for EM data in node
TYPE emNode
CHARACTER(:), ALLOCATABLE:: type
REAL(8):: phi
REAL(8):: B(1:3)
@ -160,12 +159,12 @@ MODULE moduleOutput
END SUBROUTINE calculateOutput
SUBROUTINE printTime(t, first)
SUBROUTINE printTime(first)
USE moduleSpecies
USE moduleCompTime
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
INTEGER, INTENT(in):: t
LOGICAL, INTENT(in), OPTIONAL:: first
CHARACTER(:), ALLOCATABLE:: fileName
@ -187,7 +186,7 @@ MODULE moduleOutput
OPEN(20, file = path // folder // '/' // fileName, position = 'append', action = 'write')
WRITE (20, "(I10, I10, 7(ES20.6E3))") t, nPartOld, tStep, tPush, tReset, tColl, tCoul, tWeight, tEMField
WRITE (20, "(I10, I10, 7(ES20.6E3))") timeStep, nPartOld, tStep, tPush, tReset, tColl, tCoul, tWeight, tEMField
CLOSE(20)

View file

@ -1,55 +1,202 @@
!Module to solve the electromagnetic field
MODULE moduleEM
USE moduleMesh
USE moduleTable
IMPLICIT NONE
TYPE:: boundaryEM
CHARACTER(:), ALLOCATABLE:: typeEM
INTEGER:: physicalSurface
! Generic type for electromagnetic boundary conditions
TYPE, PUBLIC, ABSTRACT:: boundaryEMGeneric
INTEGER:: nNodes
TYPE(meshNodePointer), ALLOCATABLE:: nodes(:)
CONTAINS
PROCEDURE(applyEM_interface), DEFERRED, PASS:: apply
END TYPE boundaryEMGeneric
ABSTRACT INTERFACE
! Apply boundary condition to the load vector for the Poission equation
SUBROUTINE applyEM_interface(self, vectorF)
IMPORT boundaryEMGeneric
CLASS(boundaryEMGeneric), INTENT(in):: self
REAL(8), INTENT(inout):: vectorF(:)
END SUBROUTINE applyEM_interface
END INTERFACE
TYPE, EXTENDS(boundaryEMGeneric):: boundaryEMDirichlet
REAL(8):: potential
CONTAINS
PROCEDURE, PASS:: apply
! boundaryEMGeneric DEFERRED PROCEDURES
PROCEDURE, PASS:: apply => applyDirichlet
END TYPE boundaryEM
END TYPE boundaryEMDirichlet
TYPE, EXTENDS(boundaryEMGeneric):: boundaryEMDirichletTime
REAL(8):: potential
TYPE(table1D):: temporalProfile
CONTAINS
! boundaryEMGeneric DEFERRED PROCEDURES
PROCEDURE, PASS:: apply => applyDirichletTime
END TYPE boundaryEMDirichletTime
! Container for boundary conditions
TYPE:: boundaryEMCont
CLASS(boundaryEMGeneric), ALLOCATABLE:: obj
END TYPE boundaryEMCont
INTEGER:: nBoundaryEM
TYPE(boundaryEM), ALLOCATABLE:: boundEM(:)
TYPE(boundaryEMCont), ALLOCATABLE:: boundaryEM(:)
!Information of charge and reference parameters for rho vector
REAL(8), ALLOCATABLE:: qSpecies(:)
CONTAINS
!Apply boundary conditions to the K matrix for Poisson's equation
SUBROUTINE apply(self, edge)
SUBROUTINE findNodes(self, physicalSurface)
USE moduleMesh
IMPLICIT NONE
CLASS(boundaryEM), INTENT(in):: self
CLASS(meshEdge):: edge
INTEGER:: nNodes
INTEGER, ALLOCATABLE:: nodes(:)
INTEGER:: n
CLASS(boundaryEMGeneric), INTENT(inout):: self
INTEGER, INTENT(in):: physicalSurface
CLASS(meshEdge), POINTER:: edge
INTEGER, ALLOCATABLE:: nodes(:), nodesEdge(:)
INTEGER:: nNodes, nodesNew
INTEGER:: e, n
!Temporal array to hold nodes
ALLOCATE(nodes(0))
! Loop thorugh the edges and identify those that are part of the boundary
DO e = 1, mesh%numEdges
edge => mesh%edges(e)%obj
IF (edge%physicalSurface == physicalSurface) THEN
! Edge is of the right boundary index
! Get nodes in the edge
nNodes = edge%nNodes
nodes = edge%getNodes(nNodes)
nodesEdge = edge%getNodes(nNodes)
! Collect all nodes that are not already in the temporal array
DO n = 1, nNodes
SELECT CASE(self%typeEM)
CASE ("dirichlet")
mesh%K(nodes(n), :) = 0.D0
mesh%K(nodes(n), nodes(n)) = 1.D0
IF (ANY(nodes == nodesEdge(n))) THEN
! Node already in array, skip
CYCLE
mesh%nodes(nodes(n))%obj%emData%type = self%typeEM
mesh%nodes(nodes(n))%obj%emData%phi = self%potential
ELSE
! If not, add element to array of nodes
nodes = [nodes, nodesEdge(n)]
END SELECT
END IF
END DO
END SUBROUTINE
END IF
END DO
! Point boundary to nodes
nNodes = SIZE(nodes)
ALLOCATE(self%nodes(nNodes))
self%nNodes = nNodes
DO n = 1, nNodes
self%nodes(n)%obj => mesh%nodes(nodes(n))%obj
END DO
END SUBROUTINE findNodes
! Initialize Dirichlet boundary condition
SUBROUTINE initDirichlet(self, physicalSurface, potential)
USE moduleRefParam, ONLY: Volt_ref
IMPLICIT NONE
CLASS(boundaryEMGeneric), ALLOCATABLE, INTENT(out):: self
INTEGER, INTENT(in):: physicalSurface
REAL(8), INTENT(in):: potential
! Allocate boundary edge
ALLOCATE(boundaryEMDirichlet:: self)
SELECT TYPE(self)
TYPE IS(boundaryEMDirichlet)
self%potential = potential / Volt_ref
CALL findNodes(self, physicalSurface)
END SELECT
END SUBROUTINE initDirichlet
! Initialize Dirichlet boundary condition
SUBROUTINE initDirichletTime(self, physicalSurface, potential, temporalProfile)
USE moduleRefParam, ONLY: Volt_ref, ti_ref
IMPLICIT NONE
CLASS(boundaryEMGeneric), ALLOCATABLE, INTENT(out):: self
INTEGER, INTENT(in):: physicalSurface
REAL(8), INTENT(in):: potential
CHARACTER(:), ALLOCATABLE, INTENT(in):: temporalProfile
! Allocate boundary edge
ALLOCATE(boundaryEMDirichletTime:: self)
SELECT TYPE(self)
TYPE IS(boundaryEMDirichletTime)
self%potential = potential / Volt_ref
CALL findNodes(self, physicalSurface)
CALL self%temporalProfile%init(temporalProfile)
CALL self%temporalProfile%convert(1.D0/ti_ref, 1.D0)
END SELECT
END SUBROUTINE initDirichletTime
!Apply Dirichlet boundary condition to the poisson equation
SUBROUTINE applyDirichlet(self, vectorF)
USE moduleMesh
IMPLICIT NONE
CLASS(boundaryEMDirichlet), INTENT(in):: self
REAL(8), INTENT(inout):: vectorF(:)
INTEGER:: n, ni
DO n = 1, self%nNodes
self%nodes(n)%obj%emData%phi = self%potential
vectorF(self%nodes(n)%obj%n) = self%nodes(n)%obj%emData%phi
END DO
END SUBROUTINE applyDirichlet
!Apply Dirichlet boundary condition with time temporal profile
SUBROUTINE applyDirichletTime(self, vectorF)
USE moduleMesh
USE moduleCaseParam, ONLY: timeStep, tauMin
IMPLICIT NONE
CLASS(boundaryEMDirichletTime), INTENT(in):: self
REAL(8), INTENT(inout):: vectorF(:)
REAL(8):: timeFactor
INTEGER:: n, ni
timeFactor = self%temporalProfile%get(DBLE(timeStep)*tauMin)
DO n = 1, self%nNodes
self%nodes(n)%obj%emData%phi = self%potential * timeFactor
vectorF(self%nodes(n)%obj%n) = self%nodes(n)%obj%emData%phi
END DO
END SUBROUTINE applyDirichletTime
!Assemble the source vector based on the charge density to solve Poisson's equation
SUBROUTINE assembleSourceVector(vectorF)
SUBROUTINE assembleSourceVector(vectorF, n_e)
USE moduleMesh
USE moduleRefParam
IMPLICIT NONE
@ -58,8 +205,9 @@ MODULE moduleEM
REAL(8), ALLOCATABLE:: localF(:)
INTEGER, ALLOCATABLE:: nodes(:)
REAL(8), ALLOCATABLE:: rho(:)
REAL(8), INTENT(in), OPTIONAL:: n_e(1:mesh%numNodes)
INTEGER:: nNodes
INTEGER:: e, i, ni
INTEGER:: e, i, ni, b
CLASS(meshNode), POINTER:: node
!$OMP SINGLE
@ -77,6 +225,10 @@ MODULE moduleEM
ni = nodes(i)
node => mesh%nodes(ni)%obj
rho(i) = DOT_PRODUCT(qSpecies(:), node%output(:)%den/(vol_ref*node%v*n_ref))
IF (PRESENT(n_e)) THEN
rho(i) = rho(i) - n_e(i)
END IF
END DO
@ -97,18 +249,12 @@ MODULE moduleEM
!$OMP END DO
!Apply boundary conditions
!$OMP DO
DO i = 1, mesh%numNodes
node => mesh%nodes(i)%obj
!$OMP SINGLE
do b = 1, nBoundaryEM
call boundaryEM(b)%obj%apply(vectorF)
SELECT CASE(node%emData%type)
CASE ("dirichlet")
vectorF(i) = node%emData%phi
END SELECT
END DO
!$OMP END DO
end do
!$OMP END SINGLE
END SUBROUTINE assembleSourceVector
@ -156,4 +302,86 @@ MODULE moduleEM
END SUBROUTINE solveElecField
FUNCTION BoltzmannElectron(phi, n) RESULT(n_e)
USE moduleRefParam
USE moduleConstParam
IMPLICIT NONE
INTEGER, INTENT(in):: n
REAL(8), INTENT(in):: phi(1:n)
REAL(8):: n_e(1:n)
REAL(8):: n_e0 = 1.0D16, phi_0 = -500.0D0, T_e = 11604.0
INTEGER:: i
n_e = n_e0 / n_ref * exp(qe * (phi*Volt_ref - phi_0) / (kb * T_e))
RETURN
END FUNCTION BoltzmannElectron
SUBROUTINE solveElecFieldBoltzmann()
USE moduleMesh
USE moduleErrors
IMPLICIT NONE
INTEGER, SAVE:: INFO
INTEGER:: n
REAL(8), ALLOCATABLE, SAVE:: tempF(:)
REAL(8), ALLOCATABLE, SAVE:: n_e(:), phi_old(:), phi(:)
INTEGER:: k
EXTERNAL:: dgetrs
!$OMP SINGLE
ALLOCATE(tempF(1:mesh%numNodes))
ALLOCATE(n_e(1:mesh%numNodes))
ALLOCATE(phi_old(1:mesh%numNodes))
ALLOCATE(phi(1:mesh%numNodes))
!$OMP END SINGLE
!$OMP DO
DO n = 1, mesh%numNodes
phi_old(n) = mesh%nodes(n)%obj%emData%phi
END DO
!$OMP END DO
!$OMP SINGLE
DO k = 1, 100
n_e = BoltzmannElectron(phi_old, mesh%numNodes)
CALL assembleSourceVector(tempF, n_e)
CALL dgetrs('N', mesh%numNodes, 1, mesh%K, mesh%numNodes, &
mesh%IPIV, tempF, mesh%numNodes, info)
phi = tempF
PRINT *, MAXVAL(n_e), MINVAL(n_e)
PRINT *, MAXVAL(phi), MINVAL(phi)
PRINT*, k, "diff = ", MAXVAL(ABS(phi - phi_old))
phi_old = phi
END DO
!$OMP END SINGLE
IF (info == 0) THEN
!Suscessful resolution of Poission equation
!$OMP DO
DO n = 1, mesh%numNodes
mesh%nodes(n)%obj%emData%phi = phi_old(n)
END DO
!$OMP END DO
ELSE
!$OMP SINGLE
CALL criticalError('Poisson equation failed', 'solveElecFieldBoltzmann')
!$OMP END SINGLE
END IF
!$OMP SINGLE
DEALLOCATE(tempF, n_e, phi_old, phi)
!$OMP END SINGLE
END SUBROUTINE solveElecFieldBoltzmann
END MODULE moduleEM

View file

@ -138,6 +138,9 @@ MODULE moduleSolver
CASE('Electrostatic','ConstantB')
self%solveEM => solveElecField
CASE('ElectrostaticBoltzmann')
self%solveEM => solveElecFieldBoltzmann
END SELECT
END SUBROUTINE initEM
@ -491,52 +494,46 @@ MODULE moduleSolver
END SUBROUTINE updateParticleCell
!Update the information about if a species needs to be moved this iteration
SUBROUTINE updatePushSpecies(self, t)
SUBROUTINE updatePushSpecies(self)
USE moduleSpecies
USE moduleCaseparam, ONLY: timeStep
IMPLICIT NONE
CLASS(solverGeneric), INTENT(inout):: self
INTEGER, INTENT(in):: t
INTEGER:: s
DO s=1, nSpecies
self%pusher(s)%pushSpecies = MOD(t, self%pusher(s)%every) == 0
self%pusher(s)%pushSpecies = MOD(timeStep, self%pusher(s)%every) == 0
END DO
END SUBROUTINE updatePushSpecies
!Output the different data and information
SUBROUTINE doOutput(t)
SUBROUTINE doOutput()
USE moduleMesh
USE moduleOutput
USE moduleSpecies
USE moduleCompTime
USE moduleProbe
USE moduleCaseParam, ONLY: timeStep
IMPLICIT NONE
INTEGER, INTENT(in):: t
IF (t == tInitial) THEN
CALL SYSTEM('git rev-parse HEAD > ' // path // folder // '/' // 'fpack_commit.txt')
END IF
CALL outputProbes(t)
CALL outputProbes()
counterOutput = counterOutput + 1
IF (counterOutput >= triggerOutput .OR. &
t == tFinal .OR. t == tInitial) THEN
timeStep == tFinal .OR. timeStep == tInitial) THEN
!Resets output counter
counterOutput=0
CALL mesh%printOutput(t)
IF (ASSOCIATED(meshForMCC)) CALL meshForMCC%printColl(t)
CALL mesh%printEM(t)
WRITE(*, "(5X,A21,I10,A1,I10)") "t/tFinal: ", t, "/", tFinal
CALL mesh%printOutput()
IF (ASSOCIATED(meshForMCC)) CALL meshForMCC%printColl()
CALL mesh%printEM()
WRITE(*, "(5X,A21,I10,A1,I10)") "t/tFinal: ", timeStep, "/", tFinal
WRITE(*, "(5X,A21,I10)") "Particles: ", nPartOld
IF (t == 0) THEN
IF (timeStep == 0) THEN
WRITE(*, "(5X,A21,F8.1,A2)") " init time: ", 1.D3*tStep, "ms"
ELSE
@ -554,34 +551,32 @@ MODULE moduleSolver
counterCPUTime = counterCPUTime + 1
IF (counterCPUTime >= triggerCPUTime .OR. &
t == tFinal .OR. t == tInitial) THEN
timeStep == tFinal .OR. timeStep == tInitial) THEN
!Reset CPU Time counter
counterCPUTime = 0
CALL printTime(t, t == 0)
CALL printTime(timeStep == 0)
END IF
!Output average values
IF (useAverage .AND. t == tFinal) THEN
IF (useAverage .AND. timeStep == tFinal) THEN
CALL mesh%printAverage()
END IF
END SUBROUTINE doOutput
SUBROUTINE doAverage(t)
SUBROUTINE doAverage()
USE moduleAverage
USE moduleMesh
IMPLICIT NONE
INTEGER, INTENT(in):: t
INTEGER:: tAverage, n
IF (useAverage) THEN
tAverage = t - tAverageStart
tAverage = timeStep - tAverageStart
IF (tAverage == 1) THEN
!First iteration in which average scheme is used