srDFT_G2/G09/Large_core/Molecules/vqz/SiH2_1A1.inp
2019-04-01 09:40:22 +02:00

13 lines
114 B
Plaintext

#p ROCCSD(T) cc-pVQZ pop=full gfprint
G2
0,1
Si
X,1,1.
H,1,R,2,A
H,1,R,2,A,3,180.,0
R=1.52561661
A=45.67372696