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Quantum Monte Carlo study of the CO interaction with a dimer model surface for Cr(110) 期刊论文
Molecular Physics, 2003, 卷号: 101, 期号: 1-2, 页码: 277-285
Authors:  El Akramine O;  Lester WA;  Krokidis X;  Taft CA;  Guimaraes TC;  Pavao AC;  Zhu RC(朱如曾);  Lester, WA (reprint author), Univ Calif Berkeley, Lawrence Berkeley Lab, Div Chem Sci, Berkeley, CA 94720 USA.
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Electron Localization Function  Metal-surfaces  Effective Potentials  Wave-functions  Clusters  Atoms  Dissociation  Simulations  Molecules  Solids  
Quantum Monte Carlo Study of the Co Interaction with A Model Surface for Cr(110). 期刊论文
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2002, 卷号: 223, 页码: C69-C69
Authors:  El Akramine O;  Lester WA;  Krokidis X;  Taft CA;  Pavao AC;  Guimaraes TC;  Zhu RZ(朱如曾)
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Quantum monte-carlo study on the 11a' and 21a' potential-energy surfaces of he+h2 system 期刊论文
Abstracts of Papers of The American Chemical Society, 1992, 卷号: 203, 页码: 289-PHYS
Authors:  Sun ZW(孙祉伟);  Lester WA
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Quantum and variational monte-carlo interaction potentials for li2 (x1-sigma-g+) 期刊论文
Chemical Physics Letters, 1992, 卷号: 195, 期号: 4, 页码: 365-370
Authors:  Sun ZW(孙祉伟);  Barnett RN;  Lester WA
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Intermediate Internuclear Separations  Molecular Electronic-structure  Mcscf-cl Calculations  Lowest Lying States  Lithium Dimer  Li-2  Curves  Fluorescence  Dissociation  Li-7(2)