University of Hong Kong / China Guan-Hua Chen Shanghai Key Laboratory of Molecular Catalysis / Shanghai Key Laboratory of Molecular Catalysis / Zhen-Hua Li Shanghai Key Laboratory of Molecular Catalysis / Fudan University / American Institute of Physics / /
IndustryTerm
higher order energy corrections / overall correlation energy changes / relative accurate correlation energy change / electron correlation energy changes / chemical environment / unbalanced electron correlation energy calculation / atomization energy scheme / low-energy rotational barriers / energy / correlation energy changes / correlation energy / chemical reactions / large correlation energy deficiency / online article / formation tional energy / e-caprolactam / electron correlation energy / large molecular systems / electronic energy / electron correlation energy missing / linear regression correction algorithm / chemical bonds / unbalanced correlation energy / larger systems / energy expression / /
Organization
University of Hong Kong / Hong Kong / Natural Science Foundation of Shanghai Science Technology Committee Grant / American Institute of Physics / China Xiu-Jun Wang Department of Chemistry / National Natural Science Foundation of China Grant / U.S. Securities and Exchange Commission / Department of Chemistry / Fudan University / Shanghai / Center for Chemical Physics / /
Person
J. A. Pople / Jun Wang / Xue-Mei Duan / P. C. Redfern / V / L. A. Curtiss / Guo-Liang Song / V. Rassolov / P. Zapol / K. Raghavachari / P. C. Redfern / Kang-Nian Fana / J. E. Carpenter / /
JOURNAL OF CHEMICAL PHYSICS VOLUME 121, NUMBER[removed]OCTOBER 2004