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/dports/math/dbcsr/dbcsr-2.1.0/tests/
H A Ddbcsr_test_csr_conversions.F38 INTEGER :: nblkrows_total, nblkcols_total variable
88 nblkrows_total = FLOOR(rn*(max_blks_total)) + 1
93 ALLOCATE (rn_array(MAX(nblkcols_total, nblkrows_total)))
95 ALLOCATE (row_blk_sizes(nblkrows_total))
96 ALLOCATE (row_dist(nblkrows_total))
103 row_blk_sizes = FLOOR(rn_array(1:nblkrows_total)*(max_blk_size)) + 1
109 row_dist = FLOOR(rn_array(1:nblkrows_total)*npdims(1))
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/tests/
H A Ddbcsr_test_csr_conversions.F38 INTEGER :: nblkrows_total, nblkcols_total variable
88 nblkrows_total = FLOOR(rn*(max_blks_total)) + 1
93 ALLOCATE (rn_array(MAX(nblkcols_total, nblkrows_total)))
95 ALLOCATE (row_blk_sizes(nblkrows_total))
96 ALLOCATE (row_dist(nblkrows_total))
103 row_blk_sizes = FLOOR(rn_array(1:nblkrows_total)*(max_blk_size)) + 1
109 row_dist = FLOOR(rn_array(1:nblkrows_total)*npdims(1))
/dports/math/dbcsr/dbcsr-2.1.0/examples/
H A Ddbcsr_example_1.F25 INTEGER :: group, numnodes, mynode, nblkrows_total, & variable
69 nblkrows_total = 4
74 ALLOCATE (row_blk_sizes(nblkrows_total), col_blk_sizes(nblkcols_total))
80 CALL random_dist(row_dist, nblkrows_total, npdims(1))
H A Ddbcsr_example_2.F27 … nblkrows_total, nblkcols_total, node_holds_blk, max_nze, nze, & variable
72 nblkrows_total = 4
77 ALLOCATE (row_blk_sizes(nblkrows_total), col_blk_sizes(nblkcols_total))
83 CALL random_dist(row_dist, nblkrows_total, npdims(1))
H A Ddbcsr_example_3.cpp69 int nblkrows_total = 4; in main() local
73 std::vector<int> row_blk_sizes(nblkrows_total, 2), col_blk_sizes(nblkcols_total, 2); in main()
76 auto row_dist = random_dist(nblkrows_total, dims[0]); in main()
95 for(int i = 0; i < nblkrows_total; i++) in main()
H A Ddbcsr_example_3.F27 nblkrows_total, nblkcols_total, & variable
73 nblkrows_total = 4
78 ALLOCATE (row_blk_sizes(nblkrows_total), col_blk_sizes(nblkcols_total))
84 CALL random_dist(row_dist, nblkrows_total, npdims(1))
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/examples/
H A Ddbcsr_example_1.F25 INTEGER :: group, numnodes, mynode, nblkrows_total, & variable
69 nblkrows_total = 4
74 ALLOCATE (row_blk_sizes(nblkrows_total), col_blk_sizes(nblkcols_total))
80 CALL random_dist(row_dist, nblkrows_total, npdims(1))
H A Ddbcsr_example_2.F27 … nblkrows_total, nblkcols_total, node_holds_blk, max_nze, nze, & variable
72 nblkrows_total = 4
77 ALLOCATE (row_blk_sizes(nblkrows_total), col_blk_sizes(nblkcols_total))
83 CALL random_dist(row_dist, nblkrows_total, npdims(1))
H A Ddbcsr_example_3.cpp64 int nblkrows_total = 4; in main() local
68 std::vector<int> row_blk_sizes(nblkrows_total, 2), col_blk_sizes(nblkcols_total, 2); in main()
70 auto row_dist = random_dist(nblkrows_total, dims[0]); in main()
89 for(int i = 0; i < nblkrows_total; i++) in main()
H A Ddbcsr_example_3.F27 nblkrows_total, nblkcols_total, & variable
73 nblkrows_total = 4
78 ALLOCATE (row_blk_sizes(nblkrows_total), col_blk_sizes(nblkcols_total))
84 CALL random_dist(row_dist, nblkrows_total, npdims(1))
/dports/math/dbcsr/dbcsr-2.1.0/src/ops/
H A Ddbcsr_csr_conversions.F465 CALL dbcsr_get_info(brd_mat, nblkrows_total=nblkrows_total)
468 ALLOCATE (nfullcol_blkrow(nblkrows_total))
654 CALL dbcsr_get_info(brd_mat, nblkrows_total=nblkrows_total)
655 ALLOCATE (nfullcol_blkrow(nblkrows_total))
1354 nblkrows_total=nblkrows_total, &
1392 DO l = 1, nblkrows_total
1413 rdist_tmp(1:nblkrows_total) = numnodes - 1
1415 k = nblkrows_total
1425 ALLOCATE (rdist(nblkrows_total))
1427 IF (numnodes .GT. nblkrows_total) THEN
[all …]
H A Ddbcsr_io.F149 ebr = matrix%nblkrows_total
640 nblkrows_total = dbcsr_nblkrows_total(matrix)
674 linfo_size = 1 + nblkrows_total + 2*nblks
840 nblkrows_total = values(3)
846 row_blk_size => ginfo_vec(1:nblkrows_total)
898 1 + nblkrows_total + 2*val_data(1, j)
914 ALLOCATE (rowp((nblkrows_total + 1)*job_count))
930 … rowp((i - 1)*(nblkrows_total + 1) + 1:i*(nblkrows_total + 1)) = linfo_vec(1:nblkrows_total + 1)
934 linfo_vec(nblkrows_total + 2:cur_blks + nblkrows_total + 1)
936 linfo_vec(cur_blks + nblkrows_total + 2:2*cur_blks + nblkrows_total + 1)
[all …]
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/ops/
H A Ddbcsr_csr_conversions.F524 CALL dbcsr_get_info(brd_mat, nblkrows_total=nblkrows_total)
527 ALLOCATE (nfullcol_blkrow(nblkrows_total))
715 CALL dbcsr_get_info(brd_mat, nblkrows_total=nblkrows_total)
716 ALLOCATE (nfullcol_blkrow(nblkrows_total))
1422 nblkrows_total=nblkrows_total, &
1460 DO l = 1, nblkrows_total
1481 rdist_tmp(1:nblkrows_total) = numnodes - 1
1483 k = nblkrows_total
1493 ALLOCATE (rdist(nblkrows_total))
1495 IF (numnodes .GT. nblkrows_total) THEN
[all …]
H A Ddbcsr_io.F149 ebr = matrix%nblkrows_total
641 nblkrows_total = dbcsr_nblkrows_total(matrix)
675 linfo_size = 1 + nblkrows_total + 2*nblks
842 nblkrows_total = values(3)
848 row_blk_size => ginfo_vec(1:nblkrows_total)
900 1 + nblkrows_total + 2*val_data(1, j)
916 ALLOCATE (rowp((nblkrows_total + 1)*job_count))
932 … rowp((i - 1)*(nblkrows_total + 1) + 1:i*(nblkrows_total + 1)) = linfo_vec(1:nblkrows_total + 1)
936 linfo_vec(nblkrows_total + 2:cur_blks + nblkrows_total + 1)
938 linfo_vec(cur_blks + nblkrows_total + 2:2*cur_blks + nblkrows_total + 1)
[all …]
/dports/science/latte/LATTE-1.2.2/src/
H A Dinit_dbcsr.F9092 nblkrows_total=(HDIM-1)/BLKSZ + BLKSZ
97 ALLOCATE(rbs(nblkrows_total))
109 CALL myset_dist (row_dist_a, nblkrows_total, npdims(1))
/dports/math/dbcsr/dbcsr-2.1.0/src/dist/
H A Ddbcsr_dist_util.F384 meta(dbcsr_slot_nblkrows_total) = matrix%nblkrows_total
416 matrix%nblkrows_total = meta(dbcsr_slot_nblkrows_total)
478 DO br = 1, matrix%nblkrows_total
612 m%nblkrows_total, m%nblkcols_total, ", full ", &
619 n_full_blocks_total = INT(m%nblkrows_total, KIND=int_8)*INT(m%nblkcols_total, KIND=int_8)
621 IF (m%nblkrows_total /= m%nblkcols_total) &
623 n_full_blocks_total = INT(m%nblkrows_total, KIND=int_8)*(m%nblkrows_total + 1)/2
647 IF (SIZE(m%row_p) /= m%nblkrows_total + 1) &
664 IF (SIZE(row_blk_size) /= m%nblkrows_total) &
680 WRITE (*, 2047) m%row_p(1:m%nblkrows_total + 1)
[all …]
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/dist/
H A Ddbcsr_dist_util.F401 meta(dbcsr_slot_nblkrows_total) = matrix%nblkrows_total
436 matrix%nblkrows_total = meta(dbcsr_slot_nblkrows_total)
499 DO br = 1, matrix%nblkrows_total
633 m%nblkrows_total, m%nblkcols_total, ", full ", &
640 n_full_blocks_total = INT(m%nblkrows_total, KIND=int_8)*INT(m%nblkcols_total, KIND=int_8)
642 IF (m%nblkrows_total /= m%nblkcols_total) &
644 n_full_blocks_total = INT(m%nblkrows_total, KIND=int_8)*(m%nblkrows_total + 1)/2
668 IF (SIZE(m%row_p) /= m%nblkrows_total + 1) &
685 IF (SIZE(row_blk_size) /= m%nblkrows_total) &
701 WRITE (*, 2047) m%row_p(1:m%nblkrows_total + 1)
[all …]
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqs_fb_atomic_matrix_methods.F446 natoms_in_halo, nblkrows_total, nencode, ntasks_recv, ntasks_send, src local
480 nblkrows_total=nblkrows_total)
523 nblkrows_total)
541 nencode=nblkrows_total, &
641 natoms_in_halo, nblkrows_total, nencode, nhalos, ntasks_recv, ntasks_send, src local
675 nblkrows_total=nblkrows_total)
719 nblkrows_total)
738 nencode=nblkrows_total, &
H A Dqs_fb_filter_matrix_methods.F987 natoms_in_halo, nblkrows_total, & local
1044 nblkrows_total=nblkrows_total)
1060 nblkrows_total)
1072 nencode=nblkrows_total, &
1083 natoms_encode=nblkrows_total, &
1087 natoms_encode=nblkrows_total, &
1182 nblkrows_total=nblkrows_total)
1206 nblkrows_total)
1220 nencode=nblkrows_total, &
1232 natoms_encode=nblkrows_total, &
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqs_fb_atomic_matrix_methods.F446 natoms_in_halo, nblkrows_total, nencode, ntasks_recv, ntasks_send, src local
480 nblkrows_total=nblkrows_total)
523 nblkrows_total)
541 nencode=nblkrows_total, &
641 natoms_in_halo, nblkrows_total, nencode, nhalos, ntasks_recv, ntasks_send, src local
675 nblkrows_total=nblkrows_total)
719 nblkrows_total)
738 nencode=nblkrows_total, &
H A Dqs_fb_filter_matrix_methods.F987 natoms_in_halo, nblkrows_total, & local
1044 nblkrows_total=nblkrows_total)
1060 nblkrows_total)
1072 nencode=nblkrows_total, &
1083 natoms_encode=nblkrows_total, &
1087 natoms_encode=nblkrows_total, &
1182 nblkrows_total=nblkrows_total)
1206 nblkrows_total)
1220 nencode=nblkrows_total, &
1232 natoms_encode=nblkrows_total, &
[all …]
H A Drpa_util.F488 col_blk_size=col_blk_size, nblkrows_total=nblkrows_total)
491 ALLOCATE (mepos_P_from_RI_row(nblkrows_total))
501 nblkrows_total=nblkrows_total, &
506 DO row = 1, nblkrows_total
1411 CALL dbcsr_get_info(mat_3c_overl_int(1, 1, 1)%matrix, nblkrows_total=nblkrows_total)
1445 DO iblk = 1, nblkrows_total
1463 DO iblk = 1, nblkrows_total
1515 nblkrows_total=nblkrows_total)
1517 nblkrows_total_max = nblkrows_total
1559 DO iblk = 1, nblkrows_total
[all …]
/dports/math/dbcsr/dbcsr-2.1.0/src/tas/
H A Ddbcsr_tas_io.F50 INTEGER(KIND=int_8) :: nblkrows_total, nblkcols_total, nfullrows_total, & local
61 … CALL dbcsr_tas_get_info(matrix, nblkrows_total=nblkrows_total, nblkcols_total=nblkcols_total, &
70 WRITE (unit_nr_prv, "(I12,I12)", advance="no") nblkrows_total, nblkcols_total
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/exts/dbcsr/src/tas/
H A Ddbcsr_tas_io.F50 INTEGER(KIND=int_8) :: nblkrows_total, nblkcols_total, nfullrows_total, & local
61 … CALL dbcsr_tas_get_info(matrix, nblkrows_total=nblkrows_total, nblkcols_total=nblkcols_total, &
70 WRITE (unit_nr_prv, "(I12,I12)", advance="no") nblkrows_total, nblkcols_total
/dports/math/dbcsr/dbcsr-2.1.0/src/block/
H A Ddbcsr_index_operations.F550 reservation=m%nblkrows_total + 1)
665 nrows = matrix%nblkrows_total
787 INTEGER, INTENT(IN) :: nblkrows_total local
792 INTEGER, DIMENSION(1:nblkrows_total + 1), &
850 row_p(prev_row + 1:nblkrows_total + 1) = nblks
858 meta(dbcsr_slot_nblkrows_total) = nblkrows_total
892 nblkrows_total = meta(dbcsr_slot_nblkrows_total)
907 row_p(prev_row + 1:nblkrows_total + 1) = lr
1118 ntotal_rows = matrix%nblkrows_total
1187 IF (SIZE(matrix%row_p) - 1 /= matrix%nblkrows_total) &
[all …]

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