UNCOUPLED SYMMETRIC STRETCHING FREQUENCY OF H-3(+)

被引：52

作者：

DYKSTRA, CE ^{[1
]}

GAYLORD, AS ^{[1
]}

GWINN, WD ^{[1
]}

SWOPE, WC ^{[1
]}

SCHAEFER, HF ^{[1
]}

机构：

[1] UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720

来源：

JOURNAL OF CHEMICAL PHYSICS | 1978年 / 68卷 / 08期

关键词：

D O I：

10.1063/1.436175

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：3951 / 3952

页数：2

共 11 条

[1] H-3+ - AB-INITIO CALCULATION OF VIBRATION SPECTRUM [J].

CARNEY, GD ;

PORTER, RN .

JOURNAL OF CHEMICAL PHYSICS, 1976, 65 (09) :3547-3565

[2] H+/3 - GEOMETRY DEPENDENCE OF ELECTRONIC PROPERTIES [J].

CARNEY, GD ;

PORTER, RN .

JOURNAL OF CHEMICAL PHYSICS, 1974, 60 (11) :4251-4264

[3]

CARNEY GD, 1973, THESIS U ARKANSAS

[4]

CARRINGTON A, COMMUNICATION

[5] THEORY OF SELF-CONSISTENT ELECTRON PAIRS - COMPUTATIONAL METHODS AND PRELIMINARY APPLICATIONS [J].

DYKSTRA, CE ;

SCHAEFER, HF ;

MEYER, W .

JOURNAL OF CHEMICAL PHYSICS, 1976, 65 (07) :2740-2750

[6] CALCULATION OF MATRIX ELEMENTS FOR 1-DIMENSIONAL QUANTUM-MECHANICAL PROBLEMS AND APPLICATION TO ANHARMONIC OSCILLATORS [J].

HARRIS, DO ;

ENGERHOLM, GG ;

GWINN, WD .

JOURNAL OF CHEMICAL PHYSICS, 1965, 43 (05) :1515-+

[7] GAUSSIAN-TYPE FUNCTIONS FOR POLYATOMIC SYSTEMS .I. [J].

HUZINAGA, S .

JOURNAL OF CHEMICAL PHYSICS, 1965, 42 (04) :1293-&

[8] ACCURATE ADIABATIC TREATMENT OF GROUND STATE OF HYDROGEN MOLECULE [J].

KOLOS, W ;

WOLNIEWI.L .

JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (12) :3663-&

[9]

KOLOS W, 1975, J MOL SPECTROSC, V54, P303, DOI 10.1016/0022-2852(75)90083-1

[10] AB INITIO STUDIES OF SMALL MOLECULES USING 1S GAUSSIAN BASIS FUNCTIONS .2. H3+ [J].

SCHWARTZ, ME ;

SCHAAD, LJ .

JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (12) :5325-&

← 1 2 →