File: C_bigbasis.gjf

package info (click to toggle)
cclib-data 1.6.2-2
  • links: PTS, VCS
  • area: non-free
  • in suites: bookworm, bullseye, sid
  • size: 87,912 kB
  • sloc: python: 16,440; sh: 131; makefile: 79; cpp: 31
file content (8 lines) | stat: -rw-r--r-- 113 bytes parent folder | download 
1
2
3
4
5
6
7
8
 
%chk=C_bigbasis
#p HF/aug-cc-pVQZ pop=full iop(3/33=1,3/36=-1) gfinput

Title card required

0 1
 C	0.0	0.0	0.0