WEAK-INTERACTIONS BETWEEN SMALL SYSTEMS - MODELS FOR STUDYING THE NATURE OF INTERMOLECULAR FORCES AND CHALLENGING PROBLEMS FOR ABINITIO CALCULATIONS

被引:297
作者
CHALASINSKI, G [1 ]
GUTOWSKI, M [1 ]
机构
[1] UNIV UTAH, DEPT CHEM, SALT LAKE CITY, UT 84112 USA
关键词
D O I
10.1021/cr00088a007
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:943 / 962
页数:20
相关论文
共 315 条
[1]   THE COUPLED PAIR FUNCTIONAL (CPF) - A SIZE CONSISTENT MODIFICATION OF THE CI(SD) BASED ON AN ENERGY FUNCTIONAL [J].
AHLRICHS, R ;
SCHARF, P ;
EHRHARDT, C .
JOURNAL OF CHEMICAL PHYSICS, 1985, 82 (02) :890-898
[2]   INTERMOLECULAR FORCES IN SIMPLE SYSTEMS [J].
AHLRICHS, R ;
PENCO, R ;
SCOLES, G .
CHEMICAL PHYSICS, 1977, 19 (02) :119-130
[3]   CONVERGENCE PROPERTIES OF INTERMOLECULAR FORCE SERIES (1-R-EXPANSION) [J].
AHLRICHS, R .
THEORETICA CHIMICA ACTA, 1976, 41 (01) :7-15
[4]   INFLUENCE OF ELECTRON CORRELATION ON REACTION ENERGIES - DIMERIZATION ENERGIES OF BH3 AND LIH [J].
AHLRICHS, R .
THEORETICA CHIMICA ACTA, 1974, 35 (01) :59-68
[5]   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
[6]   ABINITIO PREDICTION OF PROPERTIES OF CO2, NH3, AND CO2=NH3 [J].
AMOS, RD ;
HANDY, NC ;
KNOWLES, PJ ;
RICE, JE ;
STONE, AJ .
JOURNAL OF PHYSICAL CHEMISTRY, 1985, 89 (11) :2186-2192
[7]   MODEL POTENTIAL STUDY OF THE INTERACTIONS IN AR2, KR2 AND XE2 DIMERS [J].
ANDZELM, J ;
HUZINAGA, S ;
KLOBUKOWSKI, M ;
RADZIO, E .
MOLECULAR PHYSICS, 1984, 52 (06) :1495-1513
[8]  
[Anonymous], 1971, INT J QUANTUM CHEM
[9]   Long-range interaction energy of two- and four-electron atoms [J].
Arrighini, G. P. ;
Biondi, F. ;
Guidotti, C. .
CHEMICAL PHYSICS, 1973, 2 (01) :85-94
[10]  
Arrighini P., 1981, INTERMOLECULAR FORCE, DOI [10.1007/978-3-642-93182-6, DOI 10.1007/978-3-642-93182-6]