Counterpoise-corrected potential energy surfaces of simple H-bonded systems

Theoretical Chemistry Accounts

Volumn 99, Issue 6, 1998, Pages 372-377

  Hobza, Pavel ^a   Havlas, Zdenv̌k ^b  

^a J HEYROVSKÝ INSTITUTE OF PHYSICAL CHEMISTRY   (Czech Republic)

^b INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY   (Czech Republic)

Author keywords

Counterpoise corrected gradient optimization; H bonded systems

Indexed keywords

EID: 0032221819     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s002140050034     Document Type: Article

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