THEORETICAL STUDIES OF BONDING OF OXYGEN TO MODELS OF (100) SURFACE OF NICKEL

被引：25

作者：

WALCH, SP

GODDARD, WA

机构：

来源：

SURFACE SCIENCE | 1978年 / 75卷 / 04期

关键词：

D O I：

10.1016/0039-6028(78)90182-6

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：609 / 634

页数：26

共 25 条

[11]

HUZINAGA S, UNPUBLISHED

[12] MSXALPHA TOTAL ENERGY CALCULATIONS WITH NON-MUFFIN-TIN CORRECTIONS FOR OXYGEN-CHEMISORPTION ON A NICKEL (001) SURFACE [J].

LI, CH ;

CONNOLLY, JWD .

SURFACE SCIENCE, 1977, 65 (02) :700-705

[13]

MOORE C, 1952, ATOMIC ENERGY LEVELS, V2

[14] CONFIGURATION INTERACTION STUDIES ON LOW-LYING STATES OF O2 [J].

MOSS, BJ ;

GODDARD, WA .

JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (08) :3523-3531

[15] GENERALIZED VALENCE BOND DESCRIPTION OF O2 [J].

MOSS, BJ ;

BOBROWICZ, FW ;

GODDARD, WA .

JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (11) :4632-4639

[16]

PAULING L, 1972, NATURE CHEM BOND, P93

[17]

PAULING L, 1972, NATURE CHEM BOND, P260

[18]

SOLLENBERGER MJ, 1975, THESIS CALIFORNIA I

[19] GAUSSIAN BASIS SET FOR MOLECULAR WAVEFUNCTIONS CONTAINING THIRD-ROW ATOMS [J].

WACHTERS, AJ .

JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (03) :1033-&

[20] THEORETICAL STUDIES OF BONDING OF SULFUR TO MODELS OF (100) SURFACE OF NICKEL [J].

WALCH, SP ;

GODDARD, WA .

SURFACE SCIENCE, 1978, 72 (04) :645-677

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