Update extract(), document, and test

2025-04-22 11:28:17 -04:00
parent d10e5dded2
commit 73fe2f7915
3 changed files with 11 additions and 3 deletions
--- a/unittest/force-styles/tests/mol-pair-lj_pirani.yaml
+++ b/unittest/force-styles/tests/mol-pair-lj_pirani.yaml
@ -28,7 +28,12 @@ pair_coeff: ! |
  4 4  3.0 12.0 7.0 3.1 0.015
  4 5  1.0 11.0 6.0 3.1 0.015
  5 5  1.0 10.0 6.0 3.1 0.015
-extract: ! ""
+extract: |
+  alpha 2
+  beta 2
+  gamma 2
+  rm 2
+  epsilon 2
 natoms: 29
 init_vdwl: 5331.956709045601
 init_coul: 0