NONCOVALENT INTERACTIONS OF MEDIUM STRENGTH - A REVISED INTERPRETATION AND EXAMPLES OF ITS APPLICATIONS

被引:15
作者
ALAGONA, G
CAMMI, R
GHIO, C
TOMASI, J
机构
[1] UNIV PARMA,IST CHIM FIS,I-43100 PARMA,ITALY
[2] UNIV PISA,DIPARTIMENTO CHIM & CHIM IND,I-56100 PISA,ITALY
关键词
D O I
10.1002/qua.560350115
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:223 / 239
页数:17
相关论文
共 29 条
[1]   THE EFFECT OF FULL AND LIMITED COUNTERPOISE CORRECTIONS WITH DIFFERENT BASIS-SETS ON THE ENERGY AND THE EQUILIBRIUM DISTANCE OF HYDROGEN-BONDED DIMERS [J].
ALAGONA, G ;
GHIO, C ;
CAMMI, R ;
TOMASI, J .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1987, 32 (02) :207-226
[2]   THE DECOMPOSITION OF THE SCF INTERACTION ENERGY IN HYDROGEN-BONDED DIMERS CORRECTED FOR BASIS SET SUPERPOSITION ERRORS - AN EXAMINATION OF THE BASIS SET DEPENDENCE [J].
ALAGONA, G ;
GHIO, C ;
CAMMI, R ;
TOMASI, J .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1987, 32 (02) :227-248
[3]  
Alagona G., UNPUB
[4]  
ALAGONA G, 1988, MOL PHYSICS CHEM BIO, V2, P507
[5]  
ALAGONA G, 1986, J MOL STRUC-THEOCHEM, V135, P39
[6]  
ALAGONA G, 1987, VESTN SLOV KEM DRUS, V34, P149
[7]   AN SCF-CI STUDY OF THE WATER DIMER POTENTIAL SURFACE AND THE EFFECTS OF INCLUDING THE CORRELATION-ENERGY, THE BASIS SET SUPERPOSITION ERROR AND THE DAVIDSON CORRECTION [J].
BAUM, JO ;
FINNEY, JL .
MOLECULAR PHYSICS, 1985, 55 (05) :1097-1108
[8]  
BONACCORSI R, 1980, ISRAEL J CHEM, V19, P109
[9]   ON A SEMICLASSICAL INTERPRETATION OF INTERMOLECULAR AND INTRAMOLECULAR INTERACTIONS [J].
BONACCORSI, R ;
GHIO, C ;
TOMASI, J .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1984, 26 (05) :637-686
[10]  
BONACCORSI R, 1983, INT J QUANTUM CHEM, V26, P307