Searched refs:fexc_optx_admm1 (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | atom_admm_methods.F | 71 dfexc_admmq, dxc, dxk, el1, el2, elq, elref, fexc_optx_admm1, fexc_optx_admm2, & local
315 … CALL atom_vxc_lda(admm_basis, admm1_orbs%pmat, maxl, xc_optx, fexc_optx_admm1, admm_xcmat)
343 fexc_optx_admm1, admm_xcmata, admm_xcmatb)
364 dxc = fexc_optx_ref - fexc_optx_admm1
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | atom_admm_methods.F | 71 dfexc_admmq, dxc, dxk, el1, el2, elq, elref, fexc_optx_admm1, fexc_optx_admm2, & local
315 … CALL atom_vxc_lda(admm_basis, admm1_orbs%pmat, maxl, xc_optx, fexc_optx_admm1, admm_xcmat)
343 fexc_optx_admm1, admm_xcmata, admm_xcmatb)
364 dxc = fexc_optx_ref - fexc_optx_admm1
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