TRAJECTORY-SURFACE-HOPPING STUDY OF NA(3P2P) +H2-]NA(3S2S)+H2(V',J',THETA)

被引：221

作者：

BLAIS, NC ^{[1
]}

TRUHLAR, DG ^{[1
]}

机构：

[1] UNIV MINNESOTA,DEPT CHEM,MINNEAPOLIS,MN 55455

来源：

JOURNAL OF CHEMICAL PHYSICS | 1983年 / 79卷 / 03期

关键词：

D O I：

10.1063/1.445888

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：1334 / 1342

页数：9

共 30 条

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[3] IMPROVED PARAMETRIZATION OF DIATOMICS-IN-MOLECULES POTENTIAL-ENERGY SURFACE FOR NA(3P2P)+H-2-]NA(3S2S)+H-2 [J].

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TRUHLAR, DG ;

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[4] MONTE-CARLO TRAJECTORIES - ALIGNMENT OF HBR ROTATIONAL ANGULAR-MOMENTUM AS A FUNCTION OF SCATTERING ANGLE FOR REACTION H+BR2-]HBR+BR [J].

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[5] 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

[6] COLLISIONS OF EXCITED NA ATOMS WITH H-2-MOLECULES .1. ABINITIO POTENTIAL-ENERGY SURFACES AND QUALITATIVE DISCUSSION OF THE QUENCHING PROCESS [J].

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HERTEL, IV ;

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JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (11) :5438-5448

[7] MONTE CARLO CALCULATIONS .V. 3-DIMENSIONAL STUDY OF GENERAL BIMOLECULAR INTERACTION POTENTIAL [J].

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JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (08) :2377-&

[8] PHOTODISSOCIATION OF NABR, NAL, AND KL VAPORS AND COLLISIONAL QUENCHING OF NA] (3 P-2), K] (4 P-2), AND K] (5P-2) BY FOREIGN GASES [J].

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HERM, RR .

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[9]

GEAR CW, 1964, J SIAM NUMER ANAL B, V2, P69

[10]

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