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Optimised Projections for the Ab Initio Simulation of Large and Strongly Correlated Systems [electronic resource]

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索取号:
作者:O'Regan、 David D.、SpringerLink (Online service)、
出版社:Berlin, Heidelberg : Springer Berlin Heidelberg, 2012.

Diatomic molecules : results of ab initio calculations

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索取号:O641.121/E801
作者:Mulliken、 Robert Sanderson.、Ermler、 Walter C.、
出版社:New York : Academic Press, 1977.

Bibliography of ab initio molecular wave functions : supplement for 1974-77

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索取号:O641.121-7/E801
作者:Richards、 W. G. (William Graham)、
出版社:Oxford : Clarendon Press, 1978.

Quantum chemistry literature data base : bibliography of ab initio calculations for 1978-1980

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索取号:O641.12-64/E901
作者:Ohno、 K. (Kimio)、 1926-、Morokuma、 K. (Keiji)、 1934-、
出版社:Amsterdam ; New York : Elsevier Scientific Pub. Co., 1982.

Comparison of ab initio quantum chemistry with experiment for small molecules : the state of the art

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索取号:O641.12/E902
作者:
出版社:Dordrecht ; Boston : D. Reidel Pub. Co. ; Hingham, MA, U.S.A. : Sold and distributed in the U.S.A. and Canada by Kluwer Academic Publishers, c1985.

Ab initio molecular orbital theory

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索取号:O641.12/E908
作者:
出版社:New York : Wiley, c1986.

AB initio calculation of the structures and properties of molecules

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索取号:O641/E907
作者:Dykstra、 Clifford E.、
出版社:Amsterdam ; New York : Elsevier, 1988.

Polyatomic molecules : results of ab initio calculations

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索取号:O561/E901
作者:Mulliken、 Robert Sanderson.、Ermler、 Walter C.、
出版社:New York : Academic Press, 1981.

Theoretical aspects of homogeneous catalysis : applications of ab initio molecular orbital theory

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索取号:O643.3/E995
作者:
出版社:Dordrecht ; Boston : Kluwer Academic, c1995.

量子化学基本原理和从头计算法

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索取号:O641.12/805
作者:徐光宪、黎乐民、
出版社:北京 : 科学出版社, 1980