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Volumn 100, Issue 26, 1996, Pages 10892-10911

Identifying and analyzing intermolecular bonding interactions in van der Waals molecules

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[No Author keywords available]

Indexed keywords


EID: 0001180452     PISSN: 00223654     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp953512m     Document Type: Article
Times cited : (438)

References (77)
  • 7
    • 33748485589 scopus 로고
    • International Series of Monographs on Chemistry, Oxford University Press: Oxford
    • Bader, R. F. W. Atoms in Molecules-A Quantum Theory; International Series of Monographs on Chemistry, No. 22; Oxford University Press: Oxford, 1990.
    • (1990) Atoms in Molecules-A Quantum Theory , Issue.22
    • Bader, R.F.W.1
  • 41
    • 33748495785 scopus 로고    scopus 로고
    • note
    • The fact that complete dimer wave functions are calculated and used is inconsistent with the use of the term "intermolecular" throughout this paper, in the sense that, from the point of view of the ab initio calculation, the dimer (or trimer) is a composite system, not a set of discrete molecules. We use the term "intermolecular", therefore, only to remain faithful to the intuitive concept that one can still identify distinct monomers within a complex.
  • 45
    • 0003622717 scopus 로고    scopus 로고
    • Bader, R. F. W., co-workers, Eds.; McMaster University: Hamilton, Ontario, Canada, L8S 4M1. Contact bader@ mcmail.cis.mcmaster.ca
    • AIMPAC: a suite of programs for the Theory of Atoms in Molecules; Bader, R. F. W., co-workers, Eds.; McMaster University: Hamilton, Ontario, Canada, L8S 4M1. Contact bader@ mcmail.cis.mcmaster.ca.
    • AIMPAC: A Suite of Programs for the Theory of Atoms in Molecules
  • 46
    • 33748517190 scopus 로고
    • Popelier, P. L. A., Ed.; University of Cambridge: U. K., Available from CPC Program Library, Queen's University, Belfast, Northern Ireland
    • MORPHY; Popelier, P. L. A., Ed.; University of Cambridge: U. K., 1995. Available from CPC Program Library, Queen's University, Belfast, Northern Ireland.
    • (1995) MORPHY


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.