srDFT_G2/G09/Small_core/Molecules/avdz/SiO.inp

10 lines
102 B
Plaintext
Raw Normal View History

2019-04-05 20:48:30 +02:00
#p ROCCSD(T,FreezeInnerNobleGasCore) aug-cc-pVDZ pop=full gfprint
G2
0,1
Si
O,1,sio
sio=1.51282579