ELECTRONIC BRANCHING AND BENDING POTENTIAL AT THE FHH TRANSITION-STATE

被引：4

作者：

KOLBUSZEWSKI, M

WRIGHT, JS

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1992年 / 96卷 / 07期

关键词：

D O I：

10.1063/1.462694

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：5548 / 5549

页数：2

共 8 条

[1] THEORETICAL-STUDIES OF THE POTENTIAL SURFACE FOR THE F+H-2-]HF+H REACTION [J].

BAUSCHLICHER, CW ;

WALCH, SP ;

LANGHOFF, SR ;

TAYLOR, PR ;

JAFFE, RL .

JOURNAL OF CHEMICAL PHYSICS, 1988, 88 (03) :1743-1751

[2] MONTE-CARLO TRAJECTORIES - DYNAMICS OF REACTION F+D2 ON A SEMIEMPIRICAL VALENCE-BOND POTENTIAL-ENERGY SURFACE [J].

BLAIS, NC ;

TRUHLAR, DG .

JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (03) :1090-1108

[3] A FULL-CI STUDY OF THE ENERGETICS OF THE REACTION F+H2-]HF+H [J].

KNOWLES, PJ ;

STARK, K ;

WERNER, HJ .

CHEMICAL PHYSICS LETTERS, 1991, 185 (5-6) :555-561

[4]

MUCKERMAN JT, 1981, THEOR CHEM ADV PER A, V6, P1

[5] THE POTENTIAL-ENERGY SURFACE FOR THE F+H-2 REACTION AS A FUNCTION OF BOND ANGLE IN THE SADDLE-POINT VICINITY [J].

SCHWENKE, DW ;

STECKLER, R ;

BROWN, FB ;

TRUHLAR, DG .

JOURNAL OF CHEMICAL PHYSICS, 1986, 84 (10) :5706-5710

[6] ESTIMATION OF HIGHER-ORDER CORRELATION-EFFECTS ON THE POTENTIAL-ENERGY SURFACE FOR THE F+H2 REACTION IN THE SADDLE-POINT VICINITY [J].

SCHWENKE, DW ;

STECKLER, R ;

BROWN, FB ;

TRUHLAR, DG .

JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (04) :2443-2444

[7]

Wright J.S., UNPUB

[8] THE F+H2-]HF+H REACTION - CLASSICAL AND QUANTUM REACTION DYNAMICS ON A NEW COLLINEAR ABINITIO SURFACE [J].

WRIGHT, JS ;

WILLIAMS, RJ ;

WYATT, RE .

CHEMICAL PHYSICS LETTERS, 1991, 184 (1-3) :159-167

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