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Searched refs:Per_Potentials (Results 1 – 2 of 2) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqmmm_types_low.F436 DEALLOCATE (qmmm_env%Per_Potentials)
591 DO I = 1, SIZE(Per_Potentials)
592 IF (ASSOCIATED(Per_Potentials(I)%Pot)) THEN
594 DEALLOCATE (Per_Potentials(I)%Pot%LG)
597 DEALLOCATE (Per_Potentials(I)%Pot%gx)
600 DEALLOCATE (Per_Potentials(I)%Pot%gy)
603 DEALLOCATE (Per_Potentials(I)%Pot%gz)
609 CALL pw_pool_give_back_pw(Per_Potentials(I)%Pot%pw_pool, Per_Potentials(I)%Pot%TabLR)
619 DEALLOCATE (Per_Potentials(I)%Pot)
661 DEALLOCATE (added_charges%Per_Potentials)
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqmmm_types_low.F436 DEALLOCATE (qmmm_env%Per_Potentials)
591 DO I = 1, SIZE(Per_Potentials)
592 IF (ASSOCIATED(Per_Potentials(I)%Pot)) THEN
594 DEALLOCATE (Per_Potentials(I)%Pot%LG)
597 DEALLOCATE (Per_Potentials(I)%Pot%gx)
600 DEALLOCATE (Per_Potentials(I)%Pot%gy)
603 DEALLOCATE (Per_Potentials(I)%Pot%gz)
609 CALL pw_pool_give_back_pw(Per_Potentials(I)%Pot%pw_pool, Per_Potentials(I)%Pot%TabLR)
619 DEALLOCATE (Per_Potentials(I)%Pot)
661 DEALLOCATE (added_charges%Per_Potentials)
[all …]