MOLECULAR CLUSTER THEORY FOR CHEMISORPTION OF 1ST ROW ATOMS ON NICKEL (100) SURFACES

被引：161

作者：

ELLIS, DE

ADACHI, H

AVERILL, FW

机构：

[1] FREE UNIV AMSTERDAM,SCHEIKUNDIG LAB,AMSTERDAM,NETHERLANDS

[2] OSAKA UNIV,FAC ENGN,OSAKA,JAPAN

[3] JUDSON COLL,ELGIN,IL

[4] NORTHWESTERN UNIV,EVANSTON,IL 60201

来源：

SURFACE SCIENCE | 1976年 / 58卷 / 02期

关键词：

D O I：

10.1016/0039-6028(76)90485-4

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：497 / 510

页数：14

共 56 条

[1] MOLECULAR-ORBITAL STUDIES OF DISSOCIATIVE CHEMISORPTION OF FIRST PERIOD DIATOMIC-MOLECULES AND ETHYLENE ON (100) W AND NI SURFACES
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[2] DETERMINATION OF ATOMIC POSITIONS IN C(2X2) OXYGEN STRUCTURE ON A NICKEL (100) SURFACE BY A DYNAMICAL LOW-ENERGY ELECTRON-DIFFRACTION METHOD
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[J]. PHYSICAL REVIEW LETTERS, 1973, 31 (09) : 595 - 598
[3] ANDERSSON S, TO BE PUBLISHED
[4] CALCULATION OF TOTAL ENERGY AND PRESSURE OF COMPRESSED CESIUM
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[5] CALCULATION OF COHESIVE ENERGIES AND BULK PROPERTIES OF ALKALI-METALS
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[J]. PHYSICAL REVIEW B, 1972, 6 (10): : 3637 - &
[6] AVERILL FW, 1973, J CHEM PHYS, V59, P6413
[7] Self-consistent molecular Hartree-Fock-Slater calculations - I. The computational procedure
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Ellis, D. E.
Ros, P.
[J]. CHEMICAL PHYSICS, 1973, 2 (01) : 41 - 51
[8] Self-consistent molecular Hartree-Fock-Slater calculations - II. The effect of exchange scaling in some small molecules
Baerends, E. J.
Ros, P.
[J]. CHEMICAL PHYSICS, 1973, 2 (01) : 52 - 59
[9] HARTREE-FOCK-SLATER CALCULATIONS ON CHARGE-DISTRIBUTION AND LIGAND 1S BINDING-ENERGY SHIFTS IN CARBONYL-COMPLEXES
BAERENDS, EJ
ROS, P
[J]. JOURNAL OF ELECTRON SPECTROSCOPY AND RELATED PHENOMENA, 1975, 7 (01) : 69 - 74
[10] ELECTRONIC-STRUCTURE OF TRANSITION-METAL CARBONYL-COMPLEXES - COMPARISON OF HARTREE-FOCK-SLATER CALCULATIONS WITH UV PHOTOELECTRON-SPECTRA AND IR AND RAMAN DATA
BAERENDS, EJ
ROS, P
[J]. MOLECULAR PHYSICS, 1975, 30 (06) : 1735 - 1747

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