Searched defs:gen_revPBE_BW_unrestricted (Results 1 – 2 of 2) sorted by relevance
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwpw/pspw/lib/exchange-correlation/ |
| H A D | revpbe.f | 41 real*8 DNS_CUT,ETA,ETA2,alpha_zeta,alpha_zeta2
63 real*8 GAM,iGAM,FZZ,iFZZ
69 real*8 A_1,A1_1,B1_1,B2_1,B3_1,B4_1
78 real*8 A_2,A1_2,B1_2,B2_2,B3_2,B4_2
87 real*8 A_3,A1_3,B1_3,B2_3,B3_3,B4_3
113 real*8 kf,ks,s,P0,n_onethird,pi,rs_scale
117 real*8 t,t2,t4,t6
130 real*8 Q0,Q1,Q2,Q3,Q4,Q5,Q6,Q7,Q8
131 real*8 PON,FZ,z4
143 real*8 exup,exdn,ex,ex_lda
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwpw/pspw/lib/exchange-correlation/ |
| H A D | revpbe.f | 26 subroutine gen_revPBE_BW_unrestricted(n2ft3d, subroutine
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