13 lines
142 B
Plaintext
13 lines
142 B
Plaintext
#p ROCCSD(T,FreezeInnerNobleGasCore) aug-cc-pVDZ pop=full gfprint
|
|
|
|
G2
|
|
|
|
0,3
|
|
Si
|
|
X,1,1.
|
|
H,1,R,2,A
|
|
H,1,R,2,A,3,180.,0
|
|
|
|
R=1.48656291
|
|
A=59.20730743
|