MOLLER-PLESSET PERTURBATION-THEORY CALCULATION OF ALKALINE-EARTH RARE-GAS COMPLEXES - GROUND-STATES OF MG-HE AND MG-AR

被引:25
作者
FUNK, DJ
BRECKENRIDGE, WH
SIMONS, J
CHALASINSKI, G
机构
[1] UNIV UTAH,DEPT CHEM,SALT LAKE CITY,UT 84112
[2] UNIV WARSAW,DEPT CHEM,PL-02093 WARSAW,POLAND
关键词
D O I
10.1063/1.457630
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:1114 / 1120
页数:7
相关论文
共 46 条
[1]   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
[2]  
BENNETT RR, IN PRESS J CHEM PHYS
[3]  
BINKLEY JS, 1986, GAUSSIAN 8286
[4]   A STUDY OF SHORT-RANGE REPULSIONS [J].
BOHM, HJ ;
AHLRICHS, R .
JOURNAL OF CHEMICAL PHYSICS, 1982, 77 (04) :2028-2034
[5]   COLLISION BROADENING OF MG+ AND MG BY HE [J].
BOTTCHER, C ;
DOCKEN, KK ;
DALGARNO, A .
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1975, 8 (10) :1756-1764
[6]   CALCULATION OF SMALL MOLECULAR INTERACTIONS BY DIFFERENCES OF SEPARATE TOTAL ENERGIES - SOME PROCEDURES WITH REDUCED ERRORS [J].
BOYS, SF ;
BERNARDI, F .
MOLECULAR PHYSICS, 1970, 19 (04) :553-&
[7]   ABINITIO CALCULATIONS OF EXCHANGE REPULSION BETWEEN 2 AR ATOMS [J].
CHALASINSKI, G ;
VANSMAALEN, S ;
VANDUIJNEVELDT, FB .
MOLECULAR PHYSICS, 1982, 45 (06) :1271-1278
[8]   EXCHANGE-PERTURBATION CALCULATIONS OF THE INTERACTION ENERGY BETWEEN BE ATOMS INCLUDING INTRA-ATOMIC CORRELATION-EFFECTS [J].
CHALASINSKI, G .
CHEMICAL PHYSICS, 1983, 82 (1-2) :207-213
[9]   MOLLER-PLESSET PERTURBATION-THEORY FOR VANDERWAALS COMPLEXES BOUND BY ELECTRON CORRELATION-EFFECTS - GROUND-STATES OF THE AR AND MG DIMERS [J].
CHALASINSKI, G ;
FUNK, DJ ;
SIMONS, J ;
BRECKENRIDGE, WH .
JOURNAL OF CHEMICAL PHYSICS, 1987, 87 (06) :3569-3579
[10]   WEAK-INTERACTIONS BETWEEN SMALL SYSTEMS - MODELS FOR STUDYING THE NATURE OF INTERMOLECULAR FORCES AND CHALLENGING PROBLEMS FOR ABINITIO CALCULATIONS [J].
CHALASINSKI, G ;
GUTOWSKI, M .
CHEMICAL REVIEWS, 1988, 88 (06) :943-962