PERIODIC MINDO-3 STUDY OF THE RECONSTRUCTED (111) SURFACE OF DIAMOND

被引：16

|

作者：

DOVESI, R ^{[1
]}

PISANI, C ^{[1
]}

ROETTI, C ^{[1
]}

RICART, JM ^{[1
]}

机构：

[1] UNIV BARCELONA,FAC QUIM TARRAGONA,DEPT QUIM,E-43005 TARRAGONA,SPAIN

来源：

SURFACE SCIENCE | 1987年 / 185卷 / 1-2期

关键词：

D O I：

10.1016/S0039-6028(87)80617-9

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：120 / 124

页数：5

相关论文

共 50 条

[21] A MINDO-3 AND INDO-S STUDY ON SOME METHOXYNITROANILINES
BUEMI, G
RAUDINO, A
ZUCCARELLO, F
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1981, 1 (01): : 113 - 116
[22] MINDO-3 STUDY OF SOME TETRA-ATOMIC CLUSTERS
CUTHBERTSON, AF
GLIDEWELL, C
INORGANICA CHIMICA ACTA-ARTICLES, 1981, 49 (01): : 91 - 97
[23] CONCERNING CRITICISMS OF MINDO-3 BY POPLE AND HEHRE
DEWAR, MJS
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (22) : 6591 - 6591
[24] SOME DEFICIENCIES OF MINDO-3 SEMIEMPIRICAL THEORY
POPLE, JA
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (18) : 5306 - 5308
[25] MINDO-3 METHOD IN THERMODYNAMIC ISOTOPIC EFFECTS
ENGEL, G
KOHLER, HJ
WEISS, C
TETRAHEDRON LETTERS, 1979, (32) : 2975 - 2978
[26] MINDO-3 STUDY OF (CH)5+ AND (CH)5-
DEWAR, MJS
HADDON, RC
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (17) : 5836 - 5837
[27] HYDROGEN-BONDING IN MINDO-3 APPROXIMATION
KLOPMAN, G
ANDREOZZI, P
HOPFINGER, AJ
KIKUCHI, O
DEWAR, MJS
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1978, 100 (19) : 6267 - 6268
[28] MINDO-3 STUDY OF NORRISH TYPE-II REACTION OF BUTANAL
DEWAR, MJS
DOUBLEDAY, C
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1978, 100 (16) : 4935 - 4941
[29] MINDO-3 STUDY OF THERMOLYSIS OF DIOXETANE - ROLE OF TRIPLET-STATE
DEWAR, MJS
KIRSCHNE.S
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (24) : 7578 - 7579
[30] DISSOCIATIVE CHEMISORPTION OF MOLECULAR-HYDROGEN ON GRAPHITE - A MINDO-3 STUDY
CASANAS, J
ILLAS, F
SANZ, F
VIRGILI, J
SURFACE SCIENCE, 1983, 133 (01) : 29 - 37

← 1 2 3 4 5 →