Searched refs:qtot1 (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | cp_ddapc_util.F | 864 REAL(KIND=dp), DIMENSION(:), POINTER :: qtot1, qtot2 local
869 NULLIFY (qtot1, qtot2)
870 ALLOCATE (qtot1(ndim))
879 CALL get_ddapc(qs_env, .FALSE., density_fit_section, qout1=qtot1, &
884 ddqv(:) = (qtot1 - qtot2)/(2.0_dp*dx)
885 DO kk = 1, SIZE(qtot1) - 1, SIZE(radii)
895 DEALLOCATE (qtot1)
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | cp_ddapc_util.F | 864 REAL(KIND=dp), DIMENSION(:), POINTER :: qtot1, qtot2 local
869 NULLIFY (qtot1, qtot2)
870 ALLOCATE (qtot1(ndim))
879 CALL get_ddapc(qs_env, .FALSE., density_fit_section, qout1=qtot1, &
884 ddqv(:) = (qtot1 - qtot2)/(2.0_dp*dx)
885 DO kk = 1, SIZE(qtot1) - 1, SIZE(radii)
895 DEALLOCATE (qtot1)
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