Searched refs:contr1_int_PQ (Results 1 – 2 of 2) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | xas_tdp_kernel.F | 278 SUBROUTINE sc_os_xc(xc_ker, contr1_int_PQ, dist, blk_size, donor_state, xas_tdp_env, & argument 282 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: contr1_int_PQ local 306 rhs_int => contr1_int_PQ ! contains [ (aI|P)*(P|Q)^-1 ]^T 307 ALLOCATE (lhs_int(SIZE(contr1_int_PQ))) ! will contain (aI|P)*(P|Q)^-1 * (Q|fxc|R) 409 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: contr1_int_PQ local 436 rhs_int => contr1_int_PQ 437 ALLOCATE (lhs_int(SIZE(contr1_int_PQ))) 496 SUBROUTINE rcs_xc(sg_xc_ker, tp_xc_ker, contr1_int_PQ, dist, blk_size, donor_state, & argument 500 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: contr1_int_PQ local 521 rhs_int => contr1_int_PQ ! RHS contains [ (aI|P)*(P|Q)^-1 ]^T [all …]
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | xas_tdp_kernel.F | 280 SUBROUTINE sc_os_xc(xc_ker, contr1_int_PQ, dist, blk_size, donor_state, xas_tdp_env, & argument 284 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: contr1_int_PQ local 308 rhs_int => contr1_int_PQ ! contains [ (aI|P)*(P|Q)^-1 ]^T 309 ALLOCATE (lhs_int(SIZE(contr1_int_PQ))) ! will contain (aI|P)*(P|Q)^-1 * (Q|fxc|R) 411 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: contr1_int_PQ local 438 rhs_int => contr1_int_PQ 439 ALLOCATE (lhs_int(SIZE(contr1_int_PQ))) 498 SUBROUTINE rcs_xc(sg_xc_ker, tp_xc_ker, contr1_int_PQ, dist, blk_size, donor_state, & argument 502 TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: contr1_int_PQ local 523 rhs_int => contr1_int_PQ ! RHS contains [ (aI|P)*(P|Q)^-1 ]^T [all …]
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