srDFT_G2/G09/Large_core/Molecules/vqz/LiF.inp
2019-04-01 09:40:22 +02:00

10 lines
74 B
Plaintext

#p ROCCSD(T) cc-pVQZ pop=full gfprint
G2
0,1
Li
F,1,LiF
LiF=1.56359565