Kohn-Sham Density Functional Theory Predicting and Understanding Chemistry

Kohn-Sham Density Functional Theory Predicting and Understanding Chemistry 

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Bickelhaupt FM, Baerends EJ (2000) Kohn-sham density functional theory predicting and understanding chemistry. In Lipkowitz KB Boyd DB (eds) Reviews in computational chemistry, vol. 15. Wiley-VCH, New York, pp 1-86... 

F. Matthias Bickelhaupt and Evert Jan Baerends, Kohn-Sham Density Functional Theory Predicting and Understanding Chemistry. 

Lipkowitz and D. B. Boyd, Eds., Wiley-VCH Publishers, New York, 2000, Vol. 15, pp. 1-85. Kohn-Sham Density Functional Theory Predicting and Understanding Chemistry. 

Bickelhaupt, F. M., Baerends, E. J., Kohn-Sham density functional theory predicting and understanding chemistry, Rev. Comput. Chem., 2000, 15, 14. 

Correlation energy is ultimately a convenient container for all that escapes from first-order coulombic and polarization terms. See Bickelhaupt, F. M. Baerends, E. J. Kohn-Sham density functional theory predicting and understanding chemistry, Reviews in Computational Chemistry, Vol. 15, edited by K. B. Lipkowitz and D. B. Boyd, 2000, Wiley-VCH, New Yorkp.ll Is electron correlation (not defined in a statistical sense, but according to either the quantum chemical or the DFT definition) a true physical phenomenon It is a man-made concept, related to the introduction of a convenient trial wavefunction, that is useful for our communication and understanding. ... 

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