correct force style input

2024-06-19 10:40:19 -04:00
parent 83a024b26b
commit 0aff26705c
1 changed files with 6 additions and 2 deletions
--- a/unittest/force-styles/tests/mol-pair-dpd_coul_slater_long.yaml
+++ b/unittest/force-styles/tests/mol-pair-dpd_coul_slater_long.yaml
@ -12,10 +12,10 @@ pre_commands: ! |
  variable newton_pair delete
  variable newton_pair index on
  comm_modify vel yes
+post_commands: ! |
  kspace_style ewald 1.0e-6
  kspace_modify gewald 0.3
  kspace_modify compute no
-post_commands: ! ""
 input_file: in.fourmol
 pair_style: dpd/coul/slater/long 100.0 8.0 11223344 1.0 8.0
 pair_coeff: ! |
@ -26,7 +26,11 @@ pair_coeff: ! |
  3 3 0.4 3.2 yes
  4 4 0.3 3.1 yes
  5 5 0.3 3.1 yes
-extract: ! ""
+extract: ! |
+  cut_coul 0
+  lamda 0
+  a0 2
+  gamma 2
 natoms: 29
 init_vdwl: 50.81607024833933
 init_coul: 246.30486150616926