THEORETICAL ASPECTS OF METAL ATOM CLUSTERS

被引:322
作者
KOUTECKY, J [1 ]
FANTUCCI, P [1 ]
机构
[1] UNIV MILAN, CTR CNR, DIPARTIMENTO CHIM INORGAN & METALLORGAN, I-20133 MILANO, ITALY
关键词
D O I
10.1021/cr00073a004
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:539 / 587
页数:49
相关论文
共 392 条
[1]   DISCRETE VARIATIONAL X-ALPHA CLUSTER CALCULATIONS .1. APPLICATION TO METAL CLUSTERS [J].
ADACHI, H ;
TSUKADA, M ;
SATOKO, C .
JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN, 1978, 45 (03) :875-883
[2]   MOLECULAR-ORBITAL INVESTIGATION OF CHEMISORPTION .1. HYDROGEN ON TUNGSTEN (100) SURFACE [J].
ANDERS, LW ;
HANSEN, RS ;
BARTELL, LS .
JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (10) :5277-5287
[3]   STRUCTURES, BINDING-ENERGIES, AND CHARGE-DISTRIBUTIONS FOR 2 TO 6 ATOM TI, CR, FE, AND NI CLUSTERS AND THEIR RELATIONSHIP TO NUCLEATION AND CLUSTER CATALYSIS [J].
ANDERSON, AB .
JOURNAL OF CHEMICAL PHYSICS, 1976, 64 (10) :4046-4055
[5]   MOLECULAR-ORBITAL STUDIES OF DISSOCIATIVE CHEMISORPTION OF FIRST PERIOD DIATOMIC-MOLECULES AND ETHYLENE ON (100) W AND NI SURFACES [J].
ANDERSON, AB ;
HOFFMANN, R .
JOURNAL OF CHEMICAL PHYSICS, 1974, 61 (11) :4545-4559
[6]   THEORY OF UV SPECTRA FOR NI2 AND NI3 AND HYPOTHESIS FOR ARGON MATRIX FREQUENCY-SHIFTS FOR NI ATOMS [J].
ANDERSON, AB .
JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (11) :5108-5111
[7]   MODEL POTENTIAL CALCULATIONS FOR 2ND-ROW TRANSITION-METAL MOLECULES WITHIN THE LOCAL-SPIN-DENSITY METHOD [J].
ANDZELM, J ;
RADZIO, E ;
SALAHUB, DR .
JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (09) :4573-4580
[8]   NEW DEVELOPMENTS IN THE MODEL POTENTIAL METHOD - SCO MOLECULE [J].
ANDZELM, J ;
RADZIO, E ;
BARANDIARAN, Z ;
SEIJO, L .
JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (09) :4565-4572
[9]   PSEUDOPOTENTIALS THAT WORK - FROM H TO PU [J].
BACHELET, GB ;
HAMANN, DR ;
SCHLUTER, M .
PHYSICAL REVIEW B, 1982, 26 (08) :4199-4228
[10]  
BACHMAN C, 1980, GROWTH PROPERTIES ME