Correlation Potentials and Compact Orbital Expansions

Publisher： Nova Science Publishers, Inc.

ISSN： 1941-3955

Source： International Journal of Chemical Modeling, Vol., Iss., 2016-01, pp. : 21-32

Disclaimer: Any content in publications that violate the sovereignty, the constitution or regulations of the PRC is not accepted or approved by CNPIEC.

Previous Menu Next

Related content

Phase-Space Position-Momentum Correlation and Potentials

By Laguna Humberto G. Sagar Robin P.

Entropy, Vol. 15, Iss. 5, 2013-04 ,pp. : 1516-1527

MDPI

Access to resources Recommend Favorite

Structure-Mutagenicity Correlation of Nitrated Pyrenes Calculated by Molecular Orbital Method

By YAMAGAMI SABURO OHSHIMA SHIGERU

Polycyclic Aromatic Compounds, Vol. 32, Iss. 2, 2012-03 ,pp. : 133-140

Taylor & Francis Ltd

Access to resources Recommend Favorite

The Effect of Exchange and Correlation Potentials on Adsorption of Nicotine on Graphene: A DFT Study

By Bakhshi K. Zadghaffari R. Garadaghi M. Khani A.

Fullerenes, Nanotubes and Carbon Nanostructures, Vol. 21, Iss. 8, 2013-06 ,pp. : 695-700

Taylor & Francis Ltd

Access to resources Recommend Favorite

Correlation potentials for a multiconfigurational-based density functional theory with exact exchange

By Gusarov Sergey

Theoretical Chemistry Accounts, Vol. 112, Iss. 2, 2004-05 ,pp. : 84-94

Springer Publishing Company

Access to resources Recommend Favorite

Semiempirical Molecular-Orbital Properties of Some Polycyclic Aromatic Hydrocarbons and Correlation with Environmental Toxic Equivalency Factors

By Warne M. A. Ebbels T. M. D. Lindon J. C. Nicholson J. K.

Polycyclic Aromatic Compounds, Vol. 23, Iss. 1, 2003-01 ,pp. : 23-47

Taylor & Francis Ltd

Access to resources Recommend Favorite