srDFT_G2/G09/Molecules/vdz/small_core/SO.inp

10 lines
95 B
Plaintext
Raw Normal View History

2019-03-29 16:37:51 +01:00
#p ROCCSD(T,FreezeInnerNobleGasCore) cc-pVDZ pop=full gfprint
G2
0,3
O
S,1,OS
OS=1.49681906