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update unit test for quadratic dihedral

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Evangelos Voyiatzis
2025-04-04 17:19:54 +02:00
committed by GitHub
parent 996faf7a94
commit d1dd05bf4e
1 changed files with 3 additions and 1 deletions
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unittest/force-styles/tests/dihedral-quadratic.yaml
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@ -17,7 +17,9 @@ dihedral_coeff: ! |
3 25 100 3 25 100
4 35 110 4 35 110
5 85 120 5 85 120
extract: ! "" extract: ! |
k 1
phi0 1
natoms: 29 natoms: 29
init_energy: 6216.314347066598 init_energy: 6216.314347066598
init_stress: ! |2- init_stress: ! |2-