ON THE EVALUATION OF NON-BORN-OPPENHEIMER INTERACTIONS FOR BORN-OPPENHEIMER WAVE-FUNCTIONS .5. A BODY FIXED FRAME APPROACH - APPLICATIONS TO ISOTOPE EFFECTS ON EQUILIBRIUM GEOMETRIES AND THE ADIABATIC CORRECTION FOR THE X 1-SIGMA+ STATE OF LIH

被引：39

作者：

JENSEN, JO ^{[1
]}

YARKONY, DR ^{[1
]}

机构：

[1] JOHNS HOPKINS UNIV,DEPT CHEM,BALTIMORE,MD 21218

来源：

JOURNAL OF CHEMICAL PHYSICS | 1988年 / 89卷 / 02期

关键词：

D O I：

10.1063/1.455167

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：975 / 982

页数：8

共 48 条

[1]

BAER M, 1985, THEORY CHEM REACTION, V2, pCH4

[2] EFFECTS OF ELECTRON CORRELATION ON ADIABATIC CORRECTION AND ON EQUILIBRIUM-CONSTANTS FOR ISOTOPIC EXCHANGE-REACTIONS [J].

BARDO, RD ;

KLEINMAN, LI ;

RACZKOWSKI, AW ;

WOLFSBERG, M .

JOURNAL OF CHEMICAL PHYSICS, 1978, 69 (03) :1106-1111

[3] WAVE-EQUATION OF A NONLINEAR TRIATOMIC MOLECULE AND ADIABATIC CORRECTION TO BORN-OPPENHEIMER APPROXIMATION [J].

BARDO, RD ;

WOLFSBERG, M .

JOURNAL OF CHEMICAL PHYSICS, 1977, 67 (02) :593-603

[4] ADIABATIC CORRECTION FOR NONLINEAR TRIATOMIC-MOLECULES - TECHNIQUES AND CALCULATIONS [J].

BARDO, RD ;

WOLFSBERG, M .

JOURNAL OF CHEMICAL PHYSICS, 1978, 68 (06) :2686-2695

[5] SPECTROSCOPIC STUDY OF THE E 1-EPSILON-G+ SHELF STATE IN LI-7(2) [J].

BERNHEIM, RA ;

GOLD, LP ;

TOMCZYK, CA ;

VIDAL, CR .

JOURNAL OF CHEMICAL PHYSICS, 1987, 87 (02) :861-868

[6] AN ADIABATIC STUDY OF THE A-1-SIGMA+ STATE OF LIH [J].

BISHOP, DM ;

CHEUNG, LM .

JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (12) :7265-7269

[7] AN ADIABATIC STUDY OF THE X1-SIGMA+-STATE AND A1-SIGMA+-STATE OF BEH+ [J].

BISHOP, DM ;

CHEUNG, LM .

JOURNAL OF CHEMICAL PHYSICS, 1984, 80 (09) :4341-4346

[8] AN ADIABATIC STUDY OF THE X1-SIGMA+ STATE OF LIH [J].

BISHOP, DM ;

CHEUNG, LM .

JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (03) :1396-1403

[9] THE PROPERTIES OF LIH IN ITS GROUND AND 1ST EXCITED ELECTRONIC STATE [J].

BISHOP, DM ;

CHEUNG, LM .

JOURNAL OF CHEMICAL PHYSICS, 1983, 79 (06) :2945-2950

[10]

CHEN YC, 1986, J CHEM PHYS, V85, P2436

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