A generalized hybrid orbital (GHO) method for the treatment of boundary atoms in combined QM/MM calculations

Journal of Physical Chemistry A

Volumn 102, Issue 24, 1998, Pages 4714-4721

  Gao, Jiali ^a   Amara, Patricia ^a   Alhambra, Cristobal ^a   Field, Martin J ^a  

^a NONE

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000411659     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp9809890     Document Type: Article

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