A POTENTIAL-ENERGY SURFACE STUDY OF THE 2A1 AND LOW-LYING DISSOCIATIVE STATES OF THE METHOXY RADICAL

被引：31

作者：

JACKELS, CF

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1985年 / 82卷 / 01期

关键词：

D O I：

10.1063/1.448801

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：311 / 322

页数：12

共 61 条

[1] CALCULATION OF DISSOCIATION-ENERGIES USING MANY-BODY PERTURBATION-THEORY [J].

ADAMS, GF ;

BENT, GD ;

PURVIS, GD ;

BARTLETT, RJ .

CHEMICAL PHYSICS LETTERS, 1981, 81 (03) :461-466

[2] ON THE UNIMOLECULAR REACTIONS OF CH3O AND CH2OH [J].

ADAMS, GF ;

BARTLETT, RJ ;

PURVIS, GD .

CHEMICAL PHYSICS LETTERS, 1982, 87 (04) :311-314

[3] NONRADIATIVE ELECTRONIC RELAXATION UNDER COLLISION-FREE CONDITIONS [J].

AVOURIS, P ;

GELBART, WM ;

ELSAYED, MA .

CHEMICAL REVIEWS, 1977, 77 (06) :793-833

[4] ABINITIO STUDIES OF THE STRUCTURES OF PEROXIDES AND PEROXY-RADICALS [J].

BAIR, RA ;

GODDARD, WA .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (10) :2719-2724

[5] NATURE OF CONFIGURATION-INTERACTION METHOD IN AB-INITIO CALCULATIONS .1. NE GROUND STATE [J].

BARR, TL ;

DAVIDSON, ER .

PHYSICAL REVIEW A, 1970, 1 (03) :644-&

[6] MANY-BODY PERTURBATION-THEORY ELECTRONIC-STRUCTURE CALCULATIONS FOR THE METHOXY RADICAL .1. DETERMINATION OF JAHN-TELLER ENERGY SURFACES, SPIN-ORBIT-SPLITTING, AND ZEEMAN EFFECT [J].

BENT, GD ;

ADAMS, GF ;

BARTRAM, RH ;

PURVIS, GD ;

BARTLETT, RJ .

JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (08) :4144-4156

[7] ELECTRONIC WAVE FUNCTIONS .8. A CALCULATION OF THE GROUND STATES NA+, NE AND F- [J].

BERNAL, MJM ;

BOYS, SF .

PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1952, 245 (893) :139-154

[8]

BOUGHNER RE, 1974, 5TH P FLUID PLASM DY

[9] ENERGY EXTRAPOLATION IN CI CALCULATIONS [J].

BUENKER, RJ ;

PEYERIMHOFF, SD .

THEORETICA CHIMICA ACTA, 1975, 39 (03) :217-228

[10] SPECTRUM OF HYDROXYL RADICAL [J].

CARLONE, C ;

DALBY, FW .

CANADIAN JOURNAL OF PHYSICS, 1969, 47 (18) :1945-&

← 1 2 3 4 5 6 7 →