POTENTIAL ENERGY SURFACES FOR WALDEN INVERSION REACTION

被引：7

作者：

WOOLLEY, AM

CHILD, MS

机构：

来源：

MOLECULAR PHYSICS | 1970年 / 19卷 / 05期

关键词：

D O I：

10.1080/00268977000101661

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：625 / &

共 37 条

[1] AB INITIO CALCULATIONS ON A TYPICAL SN2REACTION - ELECTRONIC STRUCTURE OF METHYL FLUORIDE AND OF TRANSITION STATE (FCH3F)- [J].

BERTHIER, G ;

DAVID, DJ ;

VEILLARD, A .

THEORETICA CHIMICA ACTA, 1969, 14 (04) :329-&

[2]

Born M, 1927, ANN PHYS-BERLIN, V84, P0457

[3]

CHILD MS, 1967, DISCUSS FARADAY SOC, P68, DOI 10.1039/df9674400068

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

CLEMENTI, E ;

RAIMONDI, DL .

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

[5] Aliphatic substitution and the walden inversion part III Comparison, using radioactive bromine, of the rates of inversion and substitution in the reaction of bromide ions with alpha-bromopropionic acid [J].

Cowdrey, WA ;

Hughes, ED ;

Nevell, TP ;

Wilson, CL .

JOURNAL OF THE CHEMICAL SOCIETY, 1938, :209-211

[6]

Goeppert-Mayer M, 1938, J CHEM PHYS, V6, P645, DOI 10.1063/1.1750138

[7]

Hellmann H, 1935, ACTA PHYSICOCHIM URS, V1, P913

[8] SPECTRUM AND STRUCTURE OF THE FREE METHYLENE RADICAL [J].

HERZBERG, G ;

SHOOSMITH, J .

NATURE, 1959, 183 (4678) :1801-1802

[9] ELECTRONIC STRUCTURE AND BINDING ENERGY OF CARBON MONOXIDE [J].

HURLEY, AC .

REVIEWS OF MODERN PHYSICS, 1960, 32 (02) :400-411

[10] THE MOLECULAR ORBITAL THEORY OF CHEMICAL VALENCY .16. A THEORY OF PAIRED-ELECTRONS IN POLYATOMIC MOLECULES [J].

HURLEY, AC ;

LENNARDJONES, J ;

POPLE, JA .

PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1953, 220 (1143) :446-455

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