3-DIMENSIONAL DIM-3C POTENTIAL-ENERGY SURFACES FOR THE REACTIONS H+XY AND X+HY (X,Y=F,CL,BR,I)

被引:59
作者
LAST, I
BAER, M
机构
关键词
D O I
10.1063/1.447077
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:3246 / 3252
页数:7
相关论文
共 57 条
[1]   MASS-SPECTROMETRIC DETERMINATION OF RATE CONSTANTS FOR H-ATOM REACTIONS WITH CL2 AND F2 [J].
ALBRIGHT, RG ;
DODONOV, AF ;
LAVROVSKAYA, GK ;
MOROSOV, II ;
TALROZE, VL .
JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (08) :3632-+
[2]   ENERGY-DISTRIBUTION AMONG REACTION PRODUCTS .5. H+X2(X=CL, BR), D+CL2 [J].
ANLAUF, KG ;
POLANYI, JC ;
WOODALL, KB ;
MACDONAL.RG ;
HORNE, DS .
JOURNAL OF CHEMICAL PHYSICS, 1972, 57 (04) :1561-&
[3]   ENERGY DISTRIBUTION AMONG REACTION PRODUCTS .2. H+X2 AND X+HY [J].
ANLAUF, KG ;
KUNTZ, PJ ;
MAYLOTTE, DH ;
PACEY, PD ;
POLANYI, JC .
DISCUSSIONS OF THE FARADAY SOCIETY, 1967, (44) :183-&
[4]  
[Anonymous], 1966, GAS PHASE REACTION R
[5]   ISOTOPIC REACTIVE SYSTEMS H+CL2 AND D+CL2 - QUANTUM-MECHANICAL TREATMENT OF COLLINEAR ARRANGEMENT [J].
BAER, M .
JOURNAL OF CHEMICAL PHYSICS, 1974, 60 (03) :1057-1064
[6]  
BAER M, 1981, POTENTIAL ENERGY SUR, P519
[7]   GENERALIZED VALENCE-BOND INVESTIGATION OF REACTION H+BR2-]HBR+BR [J].
BAYBUTT, P ;
BOBROWICZ, FW ;
KAHN, LR ;
TRUHLAR, DG .
JOURNAL OF CHEMICAL PHYSICS, 1978, 68 (11) :4809-4822
[8]   ATOMIC RESONANCE FLUORESCENCE FOR RATE CONSTANTS OF RAPID BIMOLECULAR REACTIONS .6. HYDROGEN-ATOM REACTIONS - H+CL2 FROM 300 TO 730K AND H+NO2 AT 298K [J].
BEMAND, PP ;
CLYNE, MAA .
JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS II, 1977, 73 :394-405
[9]   SADDLE POINT GEOMETRY AND BARRIER HEIGHT FOR H+F2-]HF+F [J].
BENDER, CF ;
BAUSCHLICHER, CW ;
SCHAEFER, HF .
JOURNAL OF CHEMICAL PHYSICS, 1974, 60 (09) :3707-3708
[10]   MONTE-CARLO TRAJECTORIES - REACTION H + BR2 -] HBR + BR [J].
BLAIS, NC ;
TRUHLAR, DG .
JOURNAL OF CHEMICAL PHYSICS, 1974, 61 (10) :4186-4203