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Searched refs:per_pot (Results 1 – 4 of 4) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqmmm_gpw_energy.F406 TYPE(qmmm_per_pot_type), POINTER :: per_pot local
409 NULLIFY (pgf, pot, per_pot, xdat, ydat, zdat)
422 per_pot => per_potentials(IRadTyp)%pot
423 n_rep_real = per_pot%n_rep_real
566 TYPE(qmmm_per_pot_type), POINTER :: per_pot local
578 per_pot => per_potentials(IRadTyp)%pot
579 pw => per_pot%TabLR
585 Atoms: DO Imm = 1, SIZE(per_pot%mm_atom_index)
590 LIndMM = per_pot%mm_atom_index(Imm)
H A Dqmmm_gpw_forces.F630 TYPE(qmmm_per_pot_type), POINTER :: per_pot local
635 NULLIFY (pgf, pot, per_pot)
642 per_pot => per_potentials(IRadTyp)%pot
643 n_rep_real = per_pot%n_rep_real
819 TYPE(qmmm_per_pot_type), POINTER :: per_pot local
834 per_pot => per_potentials(IRadTyp)%pot
835 pw => per_pot%TabLR
844 Atoms: DO Imm = 1, SIZE(per_pot%mm_atom_index)
849 LIndMM = per_pot%mm_atom_index(Imm)
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqmmm_gpw_energy.F406 TYPE(qmmm_per_pot_type), POINTER :: per_pot local
409 NULLIFY (pgf, pot, per_pot, xdat, ydat, zdat)
422 per_pot => per_potentials(IRadTyp)%pot
423 n_rep_real = per_pot%n_rep_real
566 TYPE(qmmm_per_pot_type), POINTER :: per_pot local
578 per_pot => per_potentials(IRadTyp)%pot
579 pw => per_pot%TabLR
585 Atoms: DO Imm = 1, SIZE(per_pot%mm_atom_index)
590 LIndMM = per_pot%mm_atom_index(Imm)
H A Dqmmm_gpw_forces.F630 TYPE(qmmm_per_pot_type), POINTER :: per_pot local
635 NULLIFY(pgf, pot, per_pot)
642 per_pot => per_potentials(IRadTyp)%pot
643 n_rep_real = per_pot%n_rep_real
819 TYPE(qmmm_per_pot_type), POINTER :: per_pot local
834 per_pot => per_potentials(IRadTyp)%pot
835 pw => per_pot%TabLR
844 Atoms: DO Imm = 1, SIZE(per_pot%mm_atom_index)
849 LIndMM = per_pot%mm_atom_index(Imm)