Remove unnecssary FIST and QS dependence for NNP run

This commit is contained in:
cschran 2021-12-07 17:19:23 +00:00 committed by Tiziano Müller
parent 652d16e9f5
commit e5dc3132a4

View file

@ -417,8 +417,6 @@ CONTAINS
subsys=subsys)
CASE (use_nnp_force)
CPASSERT(ASSOCIATED(force_env%nnp_env))
CPASSERT(.NOT. PRESENT(qs_env))
CPASSERT(.NOT. PRESENT(fist_env))
CALL nnp_env_get(force_env%nnp_env, &
nnp_potential_energy=potential_energy, &
subsys=subsys)