| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/tce/include/ |
| H A D | tce.fh | 14 integer l_spin, k_spin ! Spins of blocks
91 2 l_spin,k_spin,l_sym,k_sym,l_range,k_range,!l_offset,k_offset,
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| H A D | tce_main.fh | 76 c tce.fh < integer l_spin, k_spin ! Spins of blocks
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/tce/include/ |
| H A D | tce.fh | 14 integer l_spin, k_spin ! Spins of blocks
91 2 l_spin,k_spin,l_sym,k_sym,l_range,k_range,!l_offset,k_offset,
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| H A D | tce_main.fh | 76 c tce.fh < integer l_spin, k_spin ! Spins of blocks
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | qs_loc_methods.F | 611 ispin, istate, j, jstate, l_spin, lb, & local
647 l_spin = dft_control%nspins
650 l_spin = myspin
653 DO ispin = s_spin, l_spin
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| H A D | qs_loc_utils.F | 467 ispin, j, l_spin, lb, nao, naosub, & local
492 l_spin = nspins
495 l_spin = myspin
497 ALLOCATE (moloc_coeff(s_spin:l_spin))
498 DO ispin = s_spin, l_spin
519 DO ispin = s_spin, l_spin
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | qs_loc_methods.F | 606 ispin, istate, j, jstate, l_spin, lb, & local
642 l_spin = dft_control%nspins
645 l_spin = myspin
648 DO ispin = s_spin, l_spin
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| H A D | qs_loc_utils.F | 465 ispin, j, l_spin, lb, nao, naosub, & local
490 l_spin = nspins
493 l_spin = myspin
495 ALLOCATE (moloc_coeff(s_spin:l_spin))
496 DO ispin = s_spin, l_spin
517 DO ispin = s_spin, l_spin
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/develop/ |
| H A D | jantest.F | 1048 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin local
1842 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin local
2027 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin local
2254 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin local
2306 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin local
2419 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin local
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/develop/ |
| H A D | jantest.F | 1048 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin
1842 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin
2027 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin
2254 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin
2306 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin
2419 integer i_spin, j_spin, k_spin, l_spin, m_spin, n_spin
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/tce/gradients/ |
| H A D | tce_gradient.F | 1352 if (.not.ma_pop_stack(l_spin))
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/tce/gradients/ |
| H A D | tce_gradient.F | 1352 if (.not.ma_pop_stack(l_spin))
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/tce/ |
| H A D | tce_tile_new.F | 201 1 l_spin,k_spin)) call errquit("tce_tile_new: MA problem",4,
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| H A D | tce_property.F | 1394 if (.not.ma_pop_stack(l_spin))
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| H A D | tce_tile.F | 1234 1 l_spin,k_spin)) call errquit("tce_tile: MA problem",4,MA_ERR)
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| H A D | tce_energy.F | 11081 if (.not.ma_pop_stack(l_spin))
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/tce/ |
| H A D | tce_tile_new.F | 201 1 l_spin,k_spin)) call errquit("tce_tile_new: MA problem",4,
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| H A D | tce_property.F | 1394 if (.not.ma_pop_stack(l_spin))
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| H A D | tce_tile.F | 1234 1 l_spin,k_spin)) call errquit("tce_tile: MA problem",4,MA_ERR)
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| H A D | tce_energy.F | 11081 if (.not.ma_pop_stack(l_spin))
|