Searched refs:psi_p2 (Results 1 – 2 of 2) sorted by relevance
/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | qs_linres_current.F | 2110 TYPE(cp_fm_type), POINTER :: mo_coeff, psi0, psi_D, psi_p1, psi_p2, & local 2129 op_mom_der_ao, center_list, centers_set, psi0, psi_rxp, psi_D, psi_p1, psi_p2, & 2243 CALL cp_fm_create(psi_p2, tmp_fm_struct) 2304 CALL cp_fm_set_all(psi_p2, 0.0_dp) 2318 CALL cp_fm_to_fm(psi1_p(ispin, iiiB)%matrix, psi_p2, 1, istate, jstate) 2335 CALL cp_dbcsr_sm_fm_multiply(op_mom_ao(idir)%matrix, psi_p2, & 2350 CALL cp_dbcsr_sm_fm_multiply(op_mom_der_ao(idir2, idir)%matrix, psi_p2, & 2490 CALL cp_fm_release(psi_p2)
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | qs_linres_current.F | 2293 TYPE(cp_fm_type), POINTER :: mo_coeff, psi0, psi_D, psi_p1, psi_p2, & local 2312 op_mom_der_ao, center_list, centers_set, psi0, psi_rxp, psi_D, psi_p1, psi_p2, & 2426 CALL cp_fm_create(psi_p2, tmp_fm_struct) 2487 CALL cp_fm_set_all(psi_p2, 0.0_dp) 2501 CALL cp_fm_to_fm(psi1_p(ispin, iiiB)%matrix, psi_p2, 1, istate, jstate) 2518 CALL cp_dbcsr_sm_fm_multiply(op_mom_ao(idir)%matrix, psi_p2, & 2533 CALL cp_dbcsr_sm_fm_multiply(op_mom_der_ao(idir2, idir)%matrix, psi_p2, & 2673 CALL cp_fm_release(psi_p2)
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