| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | pao_param_fock.F | 53 INTEGER, DIMENSION(:), POINTER :: blk_sizes_pao, blk_sizes_pri local
69 CALL dbcsr_get_info(pao%matrix_Y, row_blk_size=blk_sizes_pri, col_blk_size=blk_sizes_pao)
70 n = blk_sizes_pri(iatom) ! size of primary basis
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| H A D | pao_param.F | 307 INTEGER, DIMENSION(:), POINTER :: blk_sizes_pao, blk_sizes_pri local
317 CALL dbcsr_get_info(pao%matrix_Y, row_blk_size=blk_sizes_pri, col_blk_size=blk_sizes_pao)
325 N = blk_sizes_pri(iatom) ! size of primary basis
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| H A D | pao_param_gth.F | 61 INTEGER, DIMENSION(:), POINTER :: blk_sizes_pri, col_blk_size, nterms, & local
90 CALL dbcsr_get_info(matrix_s(1)%matrix, row_blk_size=blk_sizes_pri)
92 row_blk_size = blk_sizes_pri**2
109 n = blk_sizes_pri(iatom)
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| H A D | pao_param_exp.F | 181 INTEGER, DIMENSION(:), POINTER :: blk_sizes_pao, blk_sizes_pri local
190 CALL dbcsr_get_info(pao%matrix_Y, row_blk_size=blk_sizes_pri, col_blk_size=blk_sizes_pao)
205 N = blk_sizes_pri(iatom) ! size of primary basis
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| H A D | pao_param_linpot.F | 64 … INTEGER, DIMENSION(:), POINTER :: blk_sizes_pri, col_blk_size, row_blk_size local
91 CALL dbcsr_get_info(pao%matrix_Y, row_blk_size=blk_sizes_pri)
92 row_blk_size = blk_sizes_pri**2
111 N = blk_sizes_pri(iatom)
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| H A D | pao_methods.F | 255 INTEGER, DIMENSION(:), POINTER :: blk_sizes_aux, blk_sizes_pri local
270 CALL dbcsr_get_info(matrix_s(1)%matrix, col_blk_size=blk_sizes_pri)
277 IF (blk_sizes_pri(iatom) < M) &
285 row_blk_size=blk_sizes_pri, &
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | pao_param_fock.F | 53 INTEGER, DIMENSION(:), POINTER :: blk_sizes_pao, blk_sizes_pri local
69 CALL dbcsr_get_info(pao%matrix_Y, row_blk_size=blk_sizes_pri, col_blk_size=blk_sizes_pao)
70 n = blk_sizes_pri(iatom) ! size of primary basis
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| H A D | pao_param.F | 307 INTEGER, DIMENSION(:), POINTER :: blk_sizes_pao, blk_sizes_pri local
317 CALL dbcsr_get_info(pao%matrix_Y, row_blk_size=blk_sizes_pri, col_blk_size=blk_sizes_pao)
325 N = blk_sizes_pri(iatom) ! size of primary basis
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| H A D | pao_param_gth.F | 61 INTEGER, DIMENSION(:), POINTER :: blk_sizes_pri, col_blk_size, nterms, & local
90 CALL dbcsr_get_info(matrix_s(1)%matrix, row_blk_size=blk_sizes_pri)
92 row_blk_size = blk_sizes_pri**2
109 n = blk_sizes_pri(iatom)
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| H A D | pao_param_exp.F | 181 INTEGER, DIMENSION(:), POINTER :: blk_sizes_pao, blk_sizes_pri local
190 CALL dbcsr_get_info(pao%matrix_Y, row_blk_size=blk_sizes_pri, col_blk_size=blk_sizes_pao)
205 N = blk_sizes_pri(iatom) ! size of primary basis
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| H A D | pao_param_linpot.F | 64 … INTEGER, DIMENSION(:), POINTER :: blk_sizes_pri, col_blk_size, row_blk_size local
91 CALL dbcsr_get_info(pao%matrix_Y, row_blk_size=blk_sizes_pri)
92 row_blk_size = blk_sizes_pri**2
111 N = blk_sizes_pri(iatom)
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| H A D | pao_methods.F | 255 INTEGER, DIMENSION(:), POINTER :: blk_sizes_aux, blk_sizes_pri local
270 CALL dbcsr_get_info(matrix_s(1)%matrix, col_blk_size=blk_sizes_pri)
277 IF (blk_sizes_pri(iatom) < M) &
285 row_blk_size=blk_sizes_pri, &
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