X-ALPHA MULTIPLE-SCATTERING CALCULATIONS ON COPPER, SILVER, AND GOLD PORPHINES

被引：32

作者：

SONTUM, SF ^{[1
]}

CASE, DA ^{[1
]}

机构：

[1] UNIV CALIF DAVIS,DEPT CHEM,DAVIS,CA 95616

来源：

JOURNAL OF PHYSICAL CHEMISTRY | 1982年 / 86卷 / 09期

关键词：

D O I：

10.1021/j100206a025

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

页码：1596 / 1606

页数：11

共 50 条

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[43] ATOMIC X-ALPHA CALCULATIONS BASED ON EHFS (ALPHA) = EEXP [J].

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[44] A STUDY OF THE GROUND-STATES OF BE-2,MG-2, AND CA-2 BY THE MULTIPLE-SCATTERING X-ALPHA METHOD [J].

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[45] AN OVERLAPPING SPHERES MULTIPLE-SCATTERING X-ALPHA STUDY OF THE PERFLUORO EFFECT ON THE IONIZATION-POTENTIALS AND ELECTRON TRANSMISSION SPECTRA OF FLUOROSUBSTITUTED BENZENES [J].

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[46] STRUCTURE OF (311) SURFACE OF COPPER AS DETERMINED BY MULTIPLE-SCATTERING CALCULATIONS OF LEED INTENSITIES [J].

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[47] THE X-ALPHA POTENTIAL IN ELECTRON NEON SCATTERING [J].

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[48] NEW METHOD FOR THE DESCRIPTION OF LIGAND-FIELD STATES BASED ON MULTIPLE-SCATTERING X-ALPHA RESULTS - APPLICATION TO CRCL4 [J].

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[49] PREDICTION OF THE ELECTRONIC-ENERGY LEVELS OF DOUBLY CHARGED POSITIVE MOLECULAR-IONS WITH THE AID OF THE MULTIPLE-SCATTERING X-ALPHA METHOD [J].

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[50] THEORETICAL-STUDIES ON THE PHYSICAL-PROPERTIES AND BONDING OF THE 5D METAL HEXAFLUORIDES USING THE MULTIPLE-SCATTERING X-ALPHA TECHNIQUE [J].

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