ELECTRONIC-STRUCTURE OF NICKEL TETRACYANONICKELATE NI(CN)2-/4 AND NICKEL CARBONYL NI(CO)4 - AB-INITIO LCAO-MO-SCF CALCULATION

被引:126
作者
DEMUYNCK, J [1 ]
VEILLARD, A [1 ]
机构
[1] UNIV LOUIS PASTEUR,INST CHIM,STRASBOURG 67008,FRANCE
来源
THEORETICA CHIMICA ACTA | 1973年 / 28卷 / 03期
关键词
D O I
10.1007/BF00533488
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:241 / 265
页数:25
相关论文
共 48 条
[11]   CRYSTALLINE PERTURBATION OF A MAGNETIC DIPOLE TRANSITION IN TETRACYANONICKELATES(2) [J].
DAHL, JP ;
DINGLE, R ;
VALA, MT .
ACTA CHEMICA SCANDINAVICA, 1969, 23 (01) :47-&
[12]  
DEDIEU A, UNPUBLISHED RESULTS
[13]  
DEKOCK RL, 1971, INORG CHEM, V10, P38
[14]   AB-INITIO CALCULATION OF ELECTRONIC STRUCTURE OF NI(CN)24- ION [J].
DEMUYNCK, J ;
VEILLARD, A ;
VINOT, G .
CHEMICAL PHYSICS LETTERS, 1971, 10 (05) :522-&
[15]  
DEMUYNCK J, 1972, THESIS STRASBOURG
[16]  
DEMUYNCK J, TO BE PUBLISHED
[17]  
FISCHER AK, 1959, J AM CHEM SOC, V81, P800
[18]   A MOLECULAR ORBITAL THEORY FOR SQUARE PLANAR METAL COMPLEXES [J].
GRAY, HB ;
BALLHAUSEN, CJ .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1963, 85 (03) :260-&
[19]  
Green J. C., 1970, CHEM COMMUN, P1121
[20]   CYANIDE COMPLEXES OF THE TRANSITION METALS [J].
GRIFFITH, WP .
QUARTERLY REVIEWS, 1962, 16 (02) :188-207