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more force adding fix tests

This commit is contained in:
Axel Kohlmeyer 2020-08-20 10:59:39 -04:00
parent e72ea35c40
commit ba00626764
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GPG Key ID: D9B44E93BF0C375A
4 changed files with 313 additions and 0 deletions
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76
unittest/force-styles/tests/fix-timestep-drag.yaml Normal file
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@ -0,0 +1,76 @@
---
lammps_version: 21 Jul 2020
date_generated: Thu Aug 20 10:19:50 202
epsilon: 1e-14
prerequisites: ! |
atom full
fix drag
pre_commands: ! ""
post_commands: ! |
fix move all nve
fix test solute drag 2.4 -1.0 -1.0 10.0 0.6
input_file: in.fourmol
natoms: 29
global_vector: ! |-
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run_pos: ! |2
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...

77
unittest/force-styles/tests/fix-timestep-efield_const.yaml Normal file
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@ -0,0 +1,77 @@
---
lammps_version: 21 Jul 2020
date_generated: Thu Aug 20 10:58:24 202
epsilon: 2e-13
prerequisites: ! |
atom full
fix efield
pre_commands: ! ""
post_commands: ! |
fix move all nve
fix test solute efield 0.0 -0.1 0.1
input_file: in.fourmol
natoms: 29
global_scalar: -0.0309186331146529
global_vector: ! |-
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run_pos: ! |2
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...

78
unittest/force-styles/tests/fix-timestep-efield_region.yaml Normal file
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@ -0,0 +1,78 @@
---
lammps_version: 21 Jul 2020
date_generated: Thu Aug 20 10:58:24 202
epsilon: 2e-13
prerequisites: ! |
atom full
fix efield
pre_commands: ! ""
post_commands: ! |
region half block 0 EDGE EDGE EDGE EDGE EDGE
fix move all nve
fix test solute efield 0.1 0.1 0.1 region half
input_file: in.fourmol
natoms: 29
global_scalar: -2.82714020161747
global_vector: ! |-
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run_pos: ! |2
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...

82
unittest/force-styles/tests/fix-timestep-efield_variable.yaml Normal file
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@ -0,0 +1,82 @@
---
lammps_version: 21 Jul 2020
date_generated: Thu Aug 20 10:58:24 202
epsilon: 2e-13
prerequisites: ! |
atom full
fix efield
pre_commands: ! ""
post_commands: ! |
fix init all store/state 0 x y z
variable xforce delete
variable xforce atom f_init[1]
variable zforce delete
variable zforce equal 0.1*step/10.0
fix move all nve
fix test solute efield v_xforce 0.0 v_zforce
input_file: in.fourmol
natoms: 29
global_scalar: 0
global_vector: ! |-
3 10.275935322301738 0.0 -1.1102230246251565e-16
run_pos: ! |2
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...