MOLECULAR ORBITAL CALCULATIONS ON TRANSITION ELEMENT COMPOUNDS .1. METHOD

被引：21

作者：

BROWN, RD

JAMES, BH

ODWYER, MF

机构：

来源：

THEORETICA CHIMICA ACTA | 1970年 / 17卷 / 04期

关键词：

D O I：

10.1007/BF00527453

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

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页码：264 / +

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[1] Towards an adequate molecular orbital interpretation of the ultraviolet spectrum of the permanganate ion
Brown, R. D.
James, B. H.
O'Dwyer, M. F.
Roby, K. R.
[J]. CHEMICAL PHYSICS LETTERS, 1967, 1 (10) : 459 - 464
[2] THE VARIABLE ELECTRONEGATIVITY METHOD .2. PYRROLE
BROWN, RD
HEFFERNAN, ML
[J]. AUSTRALIAN JOURNAL OF CHEMISTRY, 1959, 12 (03) : 319 - 329
[3] STUDY OF FORMALDEHYDE BY A SELF-CONSISTENT ELECTRONEGATIVITY MOLECULAR-ORBITAL METHOD
BROWN, RD
HEFFERNAN, ML
[J]. TRANSACTIONS OF THE FARADAY SOCIETY, 1958, 54 (06): : 757 - 764
[4] APPROXIMATE MOLECULAR ORBITAL THEORY FOR INORGANIC MOLECULES .1. ANALYSIS OF POSSIBLE INTEGRAL APPROXIMATIONS
BROWN, RD
ROBY, KR
[J]. THEORETICA CHIMICA ACTA, 1970, 16 (03): : 175 - +
[5] APPROXIMATE MOLECULAR ORBITAL THEORY FOR INORGANIC MOLECULES .2. METHODS OF EVALUATING BASIC PARAMETERS
BROWN, RD
ROBY, KR
[J]. THEORETICA CHIMICA ACTA, 1970, 16 (03): : 194 - +
[6] VESCF-MO STUDIES OF MOLECULES CONTAINING ATOMS FROM SECOND ROW OF PERIODIC TABLE .I. GENERAL PROBLEM
BROWN, RD
PEEL, JB
[J]. AUSTRALIAN JOURNAL OF CHEMISTRY, 1968, 21 (11) : 2589 - &
[7] APPROXIMATE MOLECULAR ORBITAL THEORY FOR INORGANIC MOLECULES .3. COMPARATIVE CALCULATIONS ON SULPHATE ANION
BROWN, RD
ROBY, KR
[J]. THEORETICA CHIMICA ACTA, 1970, 16 (04): : 278 - +
[8] ATOMIC SHIELDING PARAMETERS
BURNS, G
[J]. JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (05) : 1521 - &
[9] DENBOEF G, 1958, RECL TRAV CHIM PAY B, V77, P1064
[10] OPERATOR FOR SPIN-FORBIDDEN TRANSITIONS
ENGLMAN, R
[J]. JOURNAL OF CHEMICAL PHYSICS, 1966, 45 (07) : 2669 - &

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