Searched refs:ri_nsgf (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | xas_tdp_atom.F | 2840 ri_nsgf, ub local
2858 CALL get_gto_basis_set(ri_basis, nset=nset, maxso=maxso, nsgf=ri_nsgf)
2886 ALLOCATE (int_fxc(iatom, i)%array(ri_nsgf, ri_nsgf))
2918 ri_nsgf local
2937 CALL get_gto_basis_set(ri_basis, nset=nset, maxso=maxso, nsgf=ri_nsgf)
2986 ALLOCATE (int_fxc(iatom, 4)%array(ri_nsgf, ri_nsgf))
|
| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | xas_tdp_atom.F | 2775 nspins, ri_nsgf, sr, ub local
2794 CALL get_gto_basis_set(ri_basis, nset=nset, maxso=maxso, nsgf=ri_nsgf)
2822 ALLOCATE (int_fxc(iatom, i)%array(ri_nsgf, ri_nsgf))
2855 ri_nsgf, sr local
2875 CALL get_gto_basis_set(ri_basis, nset=nset, maxso=maxso, nsgf=ri_nsgf)
2924 ALLOCATE (int_fxc(iatom, 4)%array(ri_nsgf, ri_nsgf))
|