[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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