srDFT_G2/G09/Mixed_core/Molecules/v5z/LiF.inp
2019-04-05 16:07:41 +02:00

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%mem=100GB
%nproc=24
#p ROCCSD(T,Window=(2,0)) cc-pV5Z pop=full gfprint
G2
0,1
Li
F,1,LiF
LiF=1.56359565