AN SCF PARTITIONING SCHEME FOR HYDROGEN BOND

被引:102
作者
KOLLMAN, PA
ALLEN, LC
机构
来源
THEORETICA CHIMICA ACTA | 1970年 / 18卷 / 04期
关键词
D O I
10.1007/BF00526460
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
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页码:399 / &
相关论文
共 12 条
[1]   Energy component analysis of rotational barriers [J].
Allen, L. C. .
CHEMICAL PHYSICS LETTERS, 1968, 2 (08) :597-601
[2]  
COULSON CA, 1954, ARK FYS, V8, P245
[3]   Intermolecular energies of small water polymers [J].
Del Bene, Janet ;
Pople, J. A. .
CHEMICAL PHYSICS LETTERS, 1969, 4 (07) :426-428
[4]  
GRAHN R, 1959, ARK FYS, V15, P257
[5]  
GRAHN R, 1962, ARK FYS, V21, P1
[6]  
GRAHN R, 1962, ARK FYS, V21, P13
[7]  
KOLLMAN P, TO BE PUBLISHED
[8]   THEORY OF HYDROGEN BOND - ELECTRONIC STRUCTURE AND PROPERTIES OF WATER DIMER [J].
KOLLMAN, PA ;
ALLEN, LC .
JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (08) :3286-&
[9]  
Tsubomura H., 1954, B CHEM SOC JPN, V27, P445
[10]   SOME CALCULATIONS ON HYDROGEN BOND [J].
VANDUIJNEVELDT, FB ;
MURRELL, JN .
JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (05) :1759-+