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add tests for a few more force manipulation fixes

This commit is contained in:
Axel Kohlmeyer 2020-08-23 07:01:38 -04:00
parent c503bba008
commit fb634658de
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GPG Key ID: D9B44E93BF0C375A
3 changed files with 221 additions and 0 deletions
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74
unittest/force-styles/tests/fix-timestep-lineforce.yaml Normal file
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---
lammps_version: 21 Aug 2020
date_generated: Sun Aug 23 07:00:22 202
epsilon: 2e-13
prerequisites: ! |
atom full
fix lineforce
pre_commands: ! ""
post_commands: ! |
fix move all nve
fix test solute lineforce 0.2 -0.2 0.0
input_file: in.fourmol
natoms: 29
run_pos: ! |2
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...

73
unittest/force-styles/tests/fix-timestep-nve_noforce.yaml Normal file
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@ -0,0 +1,73 @@
---
lammps_version: 21 Aug 2020
date_generated: Sun Aug 23 06:57:37 202
epsilon: 1e-14
prerequisites: ! |
atom full
fix nve/noforce
pre_commands: ! ""
post_commands: ! |
fix test solute nve/noforce
input_file: in.fourmol
natoms: 29
run_pos: ! |2
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...

74
unittest/force-styles/tests/fix-timestep-planeforce.yaml Normal file
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@ -0,0 +1,74 @@
---
lammps_version: 21 Aug 2020
date_generated: Sun Aug 23 06:59:27 202
epsilon: 2e-13
prerequisites: ! |
atom full
fix planeforce
pre_commands: ! ""
post_commands: ! |
fix move all nve
fix test solute planeforce 0.2 -0.2 0.0
input_file: in.fourmol
natoms: 29
run_pos: ! |2
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...