/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | mscfg_types.F | 19 dbcsr_type_no_symmetry, dbcsr_work_create 301 CALL dbcsr_work_create(matrix_new, work_mutable=.TRUE.)
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H A D | almo_scf_methods.F | 33 dbcsr_type, dbcsr_type_no_symmetry, dbcsr_type_symmetric, dbcsr_work_create 102 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.) 960 CALL dbcsr_work_create(matrix_t_blk_orthog, work_mutable=.TRUE.) 961 CALL dbcsr_work_create(matrix_v_blk_orthog, work_mutable=.TRUE.) 963 CALL dbcsr_work_create(almo_scf_env%matrix_eoo(ispin), work_mutable=.TRUE.) 964 CALL dbcsr_work_create(almo_scf_env%matrix_evv_full(ispin), work_mutable=.TRUE.) 1125 CALL dbcsr_work_create(matrix_out, work_mutable=.TRUE.) 1212 CALL dbcsr_work_create(matrix_t_blk_tmp, & 1813 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.)
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H A D | ct_methods.F | 29 dbcsr_type, dbcsr_type_no_symmetry, dbcsr_work_create 1232 CALL dbcsr_work_create(tmp, work_mutable=.TRUE.) 1518 CALL dbcsr_work_create(c, work_mutable=.TRUE.) 1520 CALL dbcsr_work_create(e, work_mutable=.TRUE.)
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H A D | almo_scf_qs.F | 41 dbcsr_reserve_block2d, dbcsr_set, dbcsr_type, dbcsr_type_no_symmetry, dbcsr_work_create 286 CALL dbcsr_work_create(matrix_new, work_mutable=.TRUE.) 945 CALL dbcsr_work_create(almo_scf_env%quench_t(ispin), &
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H A D | qs_integrate_potential_product.F | 44 dbcsr_type, dbcsr_work_create 494 CALL dbcsr_work_create(dhmat(img)%matrix, work_mutable=.TRUE., n=nthread)
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H A D | domain_submatrix_methods.F | 23 dbcsr_type_symmetric, dbcsr_work_create 1407 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.)
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | mscfg_types.F | 19 dbcsr_type_no_symmetry, dbcsr_work_create 301 CALL dbcsr_work_create(matrix_new, work_mutable=.TRUE.)
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H A D | almo_scf_methods.F | 33 dbcsr_type, dbcsr_type_no_symmetry, dbcsr_type_symmetric, dbcsr_work_create 917 CALL dbcsr_work_create(matrix_t_blk_orthog, work_mutable=.TRUE.) 918 CALL dbcsr_work_create(matrix_v_blk_orthog, work_mutable=.TRUE.) 920 CALL dbcsr_work_create(almo_scf_env%matrix_eoo(ispin), work_mutable=.TRUE.) 921 CALL dbcsr_work_create(almo_scf_env%matrix_evv_full(ispin), work_mutable=.TRUE.) 1082 CALL dbcsr_work_create(matrix_out, work_mutable=.TRUE.) 1169 CALL dbcsr_work_create(matrix_t_blk_tmp, & 1770 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.)
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H A D | ct_methods.F | 29 dbcsr_type, dbcsr_type_no_symmetry, dbcsr_work_create 1232 CALL dbcsr_work_create(tmp, work_mutable=.TRUE.) 1518 CALL dbcsr_work_create(c, work_mutable=.TRUE.) 1520 CALL dbcsr_work_create(e, work_mutable=.TRUE.)
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H A D | almo_scf_qs.F | 41 dbcsr_reserve_block2d, dbcsr_set, dbcsr_type, dbcsr_type_no_symmetry, dbcsr_work_create 286 CALL dbcsr_work_create(matrix_new, work_mutable=.TRUE.) 945 CALL dbcsr_work_create(almo_scf_env%quench_t(ispin), &
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H A D | qs_integrate_potential_product.F | 43 dbcsr_type, dbcsr_work_create 460 CALL dbcsr_work_create(dhmat(img)%matrix, work_mutable=.TRUE., n=nthread)
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/dports/math/dbcsr/dbcsr-2.1.0/src/work/ |
H A D | dbcsr_work_operations.F | 101 PUBLIC :: dbcsr_create, dbcsr_work_create, dbcsr_finalize, dbcsr_special_finalize 674 SUBROUTINE dbcsr_work_create(matrix, nblks_guess, sizedata_guess, n, & subroutine 747 END SUBROUTINE dbcsr_work_create 875 CALL dbcsr_work_create(matrix, n=nwms) 1150 CALL dbcsr_work_create(matrix, &
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/work/ |
H A D | dbcsr_work_operations.F | 101 PUBLIC :: dbcsr_create, dbcsr_work_create, dbcsr_finalize, dbcsr_special_finalize 679 SUBROUTINE dbcsr_work_create(matrix, nblks_guess, sizedata_guess, n, & subroutine 753 END SUBROUTINE dbcsr_work_create 881 CALL dbcsr_work_create(matrix, n=nwms) 1159 CALL dbcsr_work_create(matrix, &
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/dports/math/dbcsr/dbcsr-2.1.0/src/ops/ |
H A D | dbcsr_transformations.F | 91 dbcsr_work_create 498 CALL dbcsr_work_create(desm, & 637 CALL dbcsr_work_create(distributed, nblks_guess=nblks, & 1481 CALL dbcsr_work_create(replicated, & 1832 CALL dbcsr_work_create(redist, & 2130 CALL dbcsr_work_create(redist, & 2380 CALL dbcsr_work_create(new_matrix, SUM(recv_count(1, :)), &
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H A D | dbcsr_test_methods.F | 60 dbcsr_work_create 378 CALL dbcsr_work_create(matrix, &
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H A D | dbcsr_operations.F | 83 dbcsr_work_create, & 245 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.) 669 CALL dbcsr_work_create(matrix_a, & 1104 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.) 1592 CALL dbcsr_work_create(matrix_b, work_mutable=.FALSE.) 2972 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.)
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/ops/ |
H A D | dbcsr_transformations.F | 91 dbcsr_work_create 503 CALL dbcsr_work_create(desm, & 643 CALL dbcsr_work_create(distributed, nblks_guess=nblks, & 1496 CALL dbcsr_work_create(replicated, & 1848 CALL dbcsr_work_create(redist, & 2147 CALL dbcsr_work_create(redist, & 2398 CALL dbcsr_work_create(new_matrix, SUM(recv_count(1, :)), &
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H A D | dbcsr_test_methods.F | 60 dbcsr_work_create 381 CALL dbcsr_work_create(matrix, &
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H A D | dbcsr_operations.F | 83 dbcsr_work_create, & 250 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.) 667 CALL dbcsr_work_create(matrix_a, & 1109 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.) 1608 CALL dbcsr_work_create(matrix_b, work_mutable=.FALSE.) 3013 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.)
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/dports/math/dbcsr/dbcsr-2.1.0/src/block/ |
H A D | dbcsr_block_access.F | 58 dbcsr_work_create 844 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.) 1012 CALL dbcsr_work_create(matrix, nblks_guess=1, &
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/block/ |
H A D | dbcsr_block_access.F | 58 dbcsr_work_create 862 CALL dbcsr_work_create(matrix, work_mutable=.TRUE.) 1031 CALL dbcsr_work_create(matrix, nblks_guess=1, &
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/dports/math/dbcsr/dbcsr-2.1.0/src/ |
H A D | dbcsr_api.F | 137 dbcsr_work_create_prv => dbcsr_work_create 247 PUBLIC :: dbcsr_work_create 876 SUBROUTINE dbcsr_work_create(matrix, nblks_guess, sizedata_guess, n, work_mutable) subroutine 882 END SUBROUTINE dbcsr_work_create argument
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/ |
H A D | dbcsr_api.F | 137 dbcsr_work_create_prv => dbcsr_work_create 247 PUBLIC :: dbcsr_work_create 881 SUBROUTINE dbcsr_work_create(matrix, nblks_guess, sizedata_guess, n, work_mutable) subroutine 887 END SUBROUTINE dbcsr_work_create argument
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/dports/math/dbcsr/dbcsr-2.1.0/src/mm/ |
H A D | dbcsr_mm.F | 104 dbcsr_work_create 819 CALL dbcsr_work_create(product_matrix, work_mutable=.FALSE., &
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/mm/ |
H A D | dbcsr_mm.F | 104 dbcsr_work_create 813 CALL dbcsr_work_create(product_matrix, work_mutable=.FALSE., &
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