THEORETICAL STABILIZATION AND SCATTERING STUDIES OF RESONANCES IN THE ADDITION-REACTION H+CO-REVERSIBLE-HCO

被引：27

作者：

GAZDY, B ^{[1
]}

BOWMAN, JM ^{[1
]}

CHO, SW ^{[1
]}

WAGNER, AF ^{[1
]}

机构：

[1] ARGONNE NATL LAB,DIV CHEM,ARGONNE,IL 60439

来源：

JOURNAL OF CHEMICAL PHYSICS | 1991年 / 94卷 / 06期

关键词：

D O I：

10.1063/1.460652

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：

We report the first coordinated stabilization and coupled channel scattering calculations of resonances for a realistic, triatomic molecule, HCO, using a global, ab initio potential-energy surface. The two set of calculations are in excellent agreement with each other for the nine resonance energies reported.

引用

页码：4192 / 4194

页数：3

共 32 条

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