CHEMISORPTIVE BONDING OF CARBON-MONOXIDE ON NICKEL (001) - FORMULATION AND APPLICATION OF A NEW PSEUDOFUNCTIONAL ELECTRON MUFFIN TIN APPROACH

被引：20

作者：

KASOWSKI, RV

RHODIN, T

TSAI, MH

机构：

[1] CORNELL UNIV,SCH APPL & ENGN PHYS,CTR MAT SCI,ITHACA,NY 14853

[2] UNIV MUNICH,INST PHYS CHEM,D-8000 MUNICH 2,FED REP GER

来源：

APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING | 1986年 / 41卷 / 01期

关键词：

D O I：

10.1007/BF00618534

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

引用

页码：61 / 73

页数：13

共 66 条

[1] THEORETICAL-STUDIES OF CO/NI(100) - GEOMETRY, VIBRATIONAL FREQUENCIES AND IONIZATION-POTENTIALS FOR THE ON-TOP SITE [J].

ALLISON, JN ;

GODDARD, WA .

SURFACE SCIENCE, 1982, 115 (03) :553-568

[2] C(2X2)CO ON NI(100) - PHOTOEMISSION ORIENTATION DETERMINATION [J].

ALLYN, CL ;

GUSTAFSSON, T ;

PLUMMER, EW .

SOLID STATE COMMUNICATIONS, 1978, 28 (01) :85-89

[3] LINEAR METHODS IN BAND THEORY [J].

ANDERSEN, OK .

PHYSICAL REVIEW B, 1975, 12 (08) :3060-3083

[4] VIBRATIONAL EXCITATIONS AND STRUCTURE OF CO CHEMISORBED ON CU(100) [J].

ANDERSSON, S .

SURFACE SCIENCE, 1979, 89 (1-3) :477-485

[5] VIBRATIONAL EXCITATIONS AND STRUCTURE OF CO ADSORBED ON NI(100) [J].

ANDERSSON, S .

SOLID STATE COMMUNICATIONS, 1977, 21 (01) :75-81

[6] STRUCTURE OF CO ADSORBED ON CU(100) AND NI(100) [J].

ANDERSSON, S ;

PENDRY, JB .

PHYSICAL REVIEW LETTERS, 1979, 43 (05) :363-366

[7] Self-consistent molecular Hartree-Fock-Slater calculations - I. The computational procedure [J].

Baerends, E. J. ;

Ellis, D. E. ;

Ros, P. .

CHEMICAL PHYSICS, 1973, 2 (01) :41-51

[8]

BAERENDS EJ, 1978, INT J QUANTUM CHEM, V12, P169

[9] BONDING AND PHOTOEMISSION OF CHEMISORBED MOLECULES - MOLECULAR-ORBITAL CLUSTER MODEL-THEORY [J].

BAGUS, PS ;

HERMANN, K ;

SEEL, M .

JOURNAL OF VACUUM SCIENCE & TECHNOLOGY, 1981, 18 (02) :435-452

[10] VIBRATIONAL EELS STUDIES OF CO CHEMISORPTION ON CLEAN AND CARBIDED (111), (100) AND (110) NICKEL SURFACES [J].

BERTOLINI, JC ;

TARDY, B .

SURFACE SCIENCE, 1981, 102 (01) :131-150

← 1 2 3 4 5 6 7 →