The generalized hybrid orbital method for combined quantum...

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta) 2000 / 08 Vol. 104; Iss. 5

The generalized hybrid orbital method for combined quantum mechanical/molecular mechanical calculations: formulation and tests of the analytical derivatives

Patricia Amara, Martin J. Field, Cristobal Alhambra, Jiali Gao
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Volume:
104
Language:
english
Pages:
8
DOI:
10.1007/s002140000153
Date:
August, 2000
File:
PDF, 157 KB
english, 2000
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