COMPARISON OF BONDING IN 1ST TRANSITION-METAL SERIES - DIATOMIC AND BULK SULFIDES AND OXIDES

被引：50

作者：

ANDERSON, AB ^{[1
]}

HONG, SY ^{[1
]}

SMIALEK, JL ^{[1
]}

机构：

[1] NASA,LEWIS RES CTR,CLEVELAND,OH 44135

来源：

JOURNAL OF PHYSICAL CHEMISTRY | 1987年 / 91卷 / 16期

关键词：

D O I：

10.1021/j100300a010

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：4250 / 4254

页数：5

共 18 条

[1] 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

[2] TOWARD A BETTER UNDERSTANDING OF THE ATOM SUPERPOSITION AND ELECTRON DELOCALIZATION MOLECULAR-ORBITAL THEORY AND A SYSTEMATIC TEST - DIATOMIC OXIDES OF THE 1ST TRANSITION-METAL SERIES, BONDING AND TRENDS [J].

ANDERSON, AB ;

GRIMES, RW ;

HONG, SY .

JOURNAL OF PHYSICAL CHEMISTRY, 1987, 91 (16) :4245-4250

[3] UNIVERSAL FORCE CONSTANT RELATIONSHIPS AND A DEFINITION OF ATOMIC RADIUS [J].

ANDERSON, AB ;

PARR, RG .

CHEMICAL PHYSICS LETTERS, 1971, 10 (03) :293-+

[4] VIBRATIONAL FORCE CONSTANTS FROM ELECTRON DENSITIES [J].

ANDERSON, AB ;

PARR, RG .

JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (08) :3375-&

[5] THEORY OF UV SPECTRA FOR NI2 AND NI3 AND HYPOTHESIS FOR ARGON MATRIX FREQUENCY-SHIFTS FOR NI ATOMS [J].

ANDERSON, AB .

JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (11) :5108-5111

[6] POISSON EQUATION FOR VIBRATIONAL POTENTIALS OF DIATOMIC-MOLECULES [J].

ANDERSON, AB ;

PARR, RG .

THEORETICA CHIMICA ACTA, 1972, 26 (04) :301-&

[7] DERIVATION OF AND COMMENTS ON BONACCORSI-SCROCCO-TOMASI POTENTIALS FOR ELECTROPHILIC ADDITIONS [J].

ANDERSON, AB .

JOURNAL OF CHEMICAL PHYSICS, 1974, 60 (06) :2477-2479

[8] EFFECTIVE MOLECULAR ELECTRONIC CHARGE DENSITIES AND VIBRATIONAL POTENTIAL-ENERGY FUNCTIONS [J].

ANDERSON, AB .

JOURNAL OF MOLECULAR SPECTROSCOPY, 1972, 44 (03) :411-424

[9] ATOMIC SCREENING CONSTANTS FROM SCF FUNCTIONS [J].

CLEMENTI, E ;

RAIMONDI, DL .

JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (11) :2686-&

[10]

Herzberg G., 1979, MOL SPECTRA MOL STRU, VIV

← 1 2 →