[molpro-user] also about optg calculation
Wang Mingwei
mingwei at hpsv.pku.edu.cn
Fri Jun 4 02:52:19 BST 2004
Hello everyone,
Once I succeeded in an optg calculation. No error information. But the result
was not satifying. I found such information:
Sorry, Model Hessian not yet available for BR
Quadratic Steepest Descent - Minimum Search
Optimization point 1
But I don't know what's the meaning. Does this have some relation with the
result? Looking forward to your suggestion.
Best regards
mingwei
Mingwei Wang
College of Chemistry and Molecular Engineering
Peking University
mingwei at hpsv.pku.edu.cn
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