Comment on "Using Kohn-Sham orbitals in symmetry-adapted perturbation theory to investigate intermolecular interactions"

被引:158
作者
Jansen, G [1 ]
Hesselmann, A [1 ]
机构
[1] Univ Dusseldorf, Inst Theoret Chem, D-40225 Dusseldorf, Germany
关键词
D O I
10.1021/jp0112774
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:11156 / 11157
页数:2
相关论文
共 9 条
[1]   ORIGINS OF STRUCTURE AND ENERGETICS OF VAN-DER-WAALS CLUSTERS FROM AB-INITIO CALCULATIONS [J].
CHALASINSKI, G ;
SZCZESNIAK, MM .
CHEMICAL REVIEWS, 1994, 94 (07) :1723-1765
[2]  
Dreizler R.M., 1990, Density Functional Theory
[3]  
FREIBERG, 2000, 10 INT C QUANT CHEM
[4]  
Gross EKU, 1996, TOP CURR CHEM, V181, P81
[5]   First-order intermolecular interaction energies from coupled-cluster Brueckner orbitals [J].
Hesselmann, A ;
Jansen, G .
JOURNAL OF CHEMICAL PHYSICS, 2000, 112 (16) :6949-6952
[6]  
JANSEN G, 1999, 35 S THEOR CHEM 1999
[7]   PERTURBATION-THEORY APPROACH TO INTERMOLECULAR POTENTIAL-ENERGY SURFACES OF VAN-DER-WAALS COMPLEXES [J].
JEZIORSKI, B ;
MOSZYNSKI, R ;
SZALEWICZ, K .
CHEMICAL REVIEWS, 1994, 94 (07) :1887-1930
[8]  
MAGNASCO V, 1991, THEORETICAL MODELS C, V4, P133
[9]   Using Kohn-Sham orbitals in symmetry-adapted perturbation theory to investigate intermolecular interactions [J].
Williams, HL ;
Chabalowski, CF .
JOURNAL OF PHYSICAL CHEMISTRY A, 2001, 105 (03) :646-659