摘要:
elsevier.com 
sci-hub.se 参考文章(44)
John C. Slater, Statistical Exchange-Correlation in the Self-Consistent Field Advances in Quantum Chemistry. ,vol. 6, pp. 1- 92 ,(1972) , 10.1016/S0065-3276(08)60541-9
D.J.M. Fassaert, A. van der Avoird, LCAO studies of hydrogen chemisorption on nickel: II. Cluster models for adsorption sites Surface Science. ,vol. 55, pp. 313- 323 ,(1976) , 10.1016/0039-6028(76)90392-7
E.J. Baerends, P. Ros, Self-consistent molecular Hartree-Fock-Slater calculations: III. The influence of non-spherical contributions to the electron density and potentials Chemical Physics. ,vol. 8, pp. 412- 418 ,(1975) , 10.1016/0301-0104(75)80152-2
A.L. Companion, Potential energy surfaces for the interaction of atomic and diatomic hydrogen with lithium metal clusters Chemical Physics. ,vol. 14, pp. 1- 6 ,(1976) , 10.1016/0301-0104(76)80023-7
C. Pisani, Approach to the embedding problem in chemisorption in a self-consistent-field-molecular-orbital formalism Physical Review B. ,vol. 17, pp. 3143- 3153 ,(1978) , 10.1103/PHYSREVB.17.3143
R. C. Baetzold, Molecular orbital description of silver clusters: Electronic structure The Journal of Chemical Physics. ,vol. 68, pp. 555- 561 ,(1978) , 10.1063/1.435765
Hans-Ottmar Beckmann, Jaroslav Koutecký, Peter Botschwina, Wilfried Meyer, Ab initio SCF and CEPA investigations of stable lithium clusters Chemical Physics Letters. ,vol. 67, pp. 119- 126 ,(1979) , 10.1016/0009-2614(79)87119-5
Charles W. Bauschlicher, Dean H. Liskow, Charles F. Bender, Henry F. Schaefer, Model studies of chemisorption. Interaction between atomic hydrogen and beryllium clusters Journal of Chemical Physics. ,vol. 62, pp. 4815- 4825 ,(1975) , 10.1063/1.430391
R. F. Marshall, R. J. Blint, A. B. Kunz, Unrestricted-Hartree-Fock approach to cluster calculations: Application to lithium Physical Review B. ,vol. 13, pp. 3333- 3338 ,(1976) , 10.1103/PHYSREVB.13.3333
Tom Ziegler, Arvi Rauk, Carbon monoxide, carbon monosulfide, molecular nitrogen, phosphorus trifluoride, and methyl isocyanide as .sigma. donors and .pi. acceptors. A theoretical study by the Hartree-Fock-Slater transition-state method Inorganic Chemistry. ,vol. 10, pp. 1755- 1759 ,(1979) , 10.1021/IC50197A006