srDFT_G2/G09/Large_core/Molecules/avtz/CH4.inp
2019-04-04 11:10:45 +02:00

15 lines
202 B
Plaintext

%nproc=24
%mem=100GB
#p ROCCSD(T) aug-cc-pVTZ pop=full gfprint
G2
0,1
C
H,1,RCH
H,1,RCH,2,109.47122063
H,1,RCH,2,109.47122063,3,109.47122063,1
H,1,RCH,2,109.47122063,3,109.47122063,-1
RCH=1.09185419