Title of article :
Applications and validations of the Minnesota density functionals
Author/Authors :
Zhao، نويسنده , , Yan and Truhlar، نويسنده , , Donald G.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2011
Pages :
13
From page :
1
To page :
13
Abstract :
We discuss and review selected recent applications and validations of the Minnesota density functionals, especially the M06 family, emphasizing nanochemistry, organic, inorganic, and biological chemistry, and catalysis and highlighting the broad accuracy of these functionals as compared to previous popular functionals for thermochemistry, kinetics, and noncovalent interactions.
Journal title :
Chemical Physics Letters
Serial Year :
2011
Journal title :
Chemical Physics Letters
Record number :
1930698
Link To Document :
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