THEORETICAL INVESTIGATION OF THE ELIMINATION AND ADDITION-REACTIONS OF METHANE AND ETHANE WITH NICKEL

被引:111
作者
BLOMBERG, MRA [1 ]
BRANDEMARK, U [1 ]
SIEGBAHN, PEM [1 ]
机构
[1] UNIV STOCKHOLM,INST THEORET PHYS,S-11346 STOCKHOLM,SWEDEN
关键词
D O I
10.1021/ja00355a005
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:5557 / 5563
页数:7
相关论文
共 25 条
[1]  
AKERMARK B, 1979, J AM CHEM SOC, V101, P5876
[2]   REDUCTIVE ELIMINATION OF HH, HCH3, AND CH3CH3 FROM BIS(PHOSPHINE)PLATINUM(II), BIS(PHOSPHINE)PALLADIUM(II), AND BIS(PHOSPHINE)NICKEL(II) COMPLEXES - A THEORETICAL-STUDY USING THE SCF-X-ALPHA-SW METHOD [J].
BALAZS, AC ;
JOHNSON, KH ;
WHITESIDES, GM .
INORGANIC CHEMISTRY, 1982, 21 (06) :2162-2174
[3]   CONTRACTED CI CALCULATIONS OF MODELS FOR CATALYTIC REACTIONS INVOLVING TRANSITION-METALS [J].
BLOMBERG, M ;
BRANDEMARK, U ;
PETTERSSON, L ;
SIEGBAHN, P .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1983, 23 (03) :855-863
[4]   AN IMPORTANT BOUND SINGLET-STATE OF NIH2 [J].
BLOMBERG, MRA ;
SIEGBAHN, PEM .
JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (02) :986-987
[5]  
BLOMBERG MRA, IN PRESS
[6]  
BRANDEMARK U, UNPUB
[7]   ALKANE DEHYDROGENATION BY IRIDIUM COMPLEXES [J].
CRABTREE, RH ;
MELLEA, MF ;
MIHELCIC, JM ;
QUIRK, JM .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (01) :107-113
[8]  
Davidson E.R., 1974, WORLD QUANTUM CHEM
[9]   METAL SIGMA-HYDROCARBYLS, MR NORMAL-STOICHIOMETRY, STRUCTURES, STABILITIES, AND THERMAL-DECOMPOSITION PATHWAYS [J].
DAVIDSON, PJ ;
LAPPERT, MF ;
PEARCE, R .
CHEMICAL REVIEWS, 1976, 76 (02) :219-242
[10]   METHANATION OF CO OVER NI CATALYST - THEORETICAL-STUDY [J].
GODDARD, WA ;
WALCH, SP ;
RAPPE, AK ;
UPTON, TH ;
MELIUS, CF .
JOURNAL OF VACUUM SCIENCE & TECHNOLOGY, 1977, 14 (01) :416-418