EXTENDED DIATOMICS IN MOLECULES CALCULATIONS

被引:87
作者
STEINER, E [1 ]
CERTAIN, PR [1 ]
KUNTZ, PJ [1 ]
机构
[1] UNIV WISCONSIN,THEORET CHEM INST,MADISON,WI 53706
关键词
D O I
10.1063/1.1679830
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
收藏
页码:47 / 55
页数:9
相关论文
共 11 条
[1]  
Bates D., 1968, ADV AT MOL PHYS, V4, P13
[2]   COMMENT ON ACTIVATION ENERGY FOR H+H2 REACTION [J].
CASHION, JK ;
HERSCHBACH, DR .
JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (07) :2199-&
[3]   MOLECULAR SCHRODINGER EQUATION .6. RESULTS FOR H3 AND OTHER SIMPLE SYSTEMS [J].
CONROY, H ;
BRUNER, BL .
JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (03) :921-&
[4]   PSEUDONATURAL ORBITALS AS A BASIS FOR SUPERPOSITION OF CONFIGURATIONS .2. ENERGY SURFACE FOR LINEAR H3 [J].
EDMISTON, C ;
KRAUSS, M .
JOURNAL OF CHEMICAL PHYSICS, 1968, 49 (01) :192-&
[5]   RESONANT STATES OF H2- [J].
ELIEZER, I ;
TAYLOR, HS ;
WILLIAMS, JK .
JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (06) :2165-&
[6]   A METHOD OF DIATOMICS IN MOLECULES .2. H3 AND H3+1 [J].
ELLISON, FO ;
PATEL, JC ;
HUFF, NT .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1963, 85 (22) :3544-&
[8]   Potential-Energy Curves for the X (1)Sigma(+)(g), b(3)Sigma(+)(u), and C (1)Pi(u) States of the Hydrogen Molecule [J].
Kolos, W. ;
Wolniewicz, L. .
JOURNAL OF CHEMICAL PHYSICS, 1965, 43 (07) :2429-2441
[9]   ION-MOLECULE REACTIONS OF RARE-GASES WITH HYDROGEN .1. DIATOMICS-IN-MOLECULES POTENTIAL-ENERGY SURFACE FOR ARH+2 [J].
KUNTZ, PJ ;
ROACH, AC .
JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS II, 1972, 68 (02) :259-&