NIO BULK PROPERTIES - INITIAL-STATE MOLECULAR-ORBITAL NI4O4 AND NI13O14 CLUSTER STUDIES

被引：11

作者：

ANDERSON, AB

机构：

[1] CASE WESTERN RESERVE UNIV,DEPT CHEM,CLEVELAND,OH 44106

[2] YALE UNIV,DEPT CHEM,NEW HAVEN,CT 06520

来源：

CHEMICAL PHYSICS LETTERS | 1980年 / 72卷 / 03期

关键词：

D O I：

10.1016/0009-2614(80)80343-5

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：514 / 517

页数：4

共 18 条

[1] DETERMINATION OF CHALCOGEN STRUCTURES ON NICKEL SURFACES FROM ORBITAL ENERGIES ADDED TO PAIRWISE ATOMIC REPULSIONS [J].

ANDERSON, AB .

JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (05) :2173-2175

[2] VIBRATIONAL POTENTIALS AND STRUCTURES IN MOLECULAR AND SOLID CARBON, SILICON, GERMANIUM, AND TIN [J].

ANDERSON, AB .

JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (10) :4430-4436

[3] DERIVATION OF EXTENDED HUCKEL METHOD WITH CORRECTIONS - ONE ELECTRON MOLECULAR-ORBITAL THEORY FOR ENERGY-LEVEL AND STRUCTURE DETERMINATIONS [J].

ANDERSON, AB .

JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (03) :1187-1188

[4] LATTICE-CONSTANTS AND FORCE CONSTANTS FOR IRON, NICKEL, AND COPPER FROM ORBITAL ENERGIES ADDED TO PAIRWISE ATOMIC REPULSIONS IN CLUSTER MODELS [J].

ANDERSON, AB .

CHEMICAL PHYSICS LETTERS, 1979, 61 (02) :388-390

[5]

ANDERSON AB, 1976, INORG CHEM, V15, P2698

[6]

[Anonymous], 1981, PRINCIPLES QUANTUM M

[7] ABINITIO SCF AND LIMITED CI CALCULATIONS ON D-D TRANSITIONS IN NIO [J].

BAGUS, PS ;

WAHLGREN, U .

MOLECULAR PHYSICS, 1977, 33 (03) :641-650

[8] LEED-UPS STUDY ON INTERACTION OF OXYGEN WITH A NI(111) SURFACE [J].

CONRAD, H ;

ERTL, G ;

KUPPERS, J ;

LATTA, EE .

SOLID STATE COMMUNICATIONS, 1975, 17 (04) :497-500

[9] PHOTOEMISSION PARTIAL STATE DENSITIES OF OVERLAPPING P AND D STATES FOR NIO, COO, FEO, MNO, AND CR2O3 [J].

EASTMAN, DE ;

FREEOUF, JL .

PHYSICAL REVIEW LETTERS, 1975, 34 (07) :395-398

[10] ORBITAL INTERACTIONS IN METAL DIMER COMPLEXES [J].

HAY, PJ ;

THIBEAULT, JC ;

HOFFMANN, R .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (17) :4884-4899

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