srDFT_G2/G09/Small_core/Molecules/avdz/SiH3.inp
2019-04-05 20:48:30 +02:00

14 lines
175 B
Plaintext

#p ROCCSD(T,FreezeInnerNobleGasCore) aug-cc-pVDZ pop=full gfprint
G2
0,2
Si
X,1,1.
H,1,R,2,BETA
H,1,R,2,BETA,3,120.,0
H,1,R,2,BETA,3,-120.,0
R=1.48480778
BETA=107.89090342