Next: 43.4.1 Simple HF optimization Up: 43 GEOMETRY OPTIMIZATION (OPTG) Previous: 43.3.3 Additional options for

43.4 Examples

Input: h2o_scfopt_631g.com

Output: h2o_scfopt_631g.out Input: h2o_optmp2.com

Output: h2o_optmp2.out Input: h2o_optmp2_runccsdt.com

Output: h2o_optmp2_runccsdt.out


Subsections
molpro@molpro.net
Oct 10, 2007