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Volumn 217, Issue 1-2, 1994, Pages 48-54

A possible definition of basis set superposition error

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[No Author keywords available]

Indexed keywords


EID: 0003111092     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/0009-2614(93)E1356-L     Document Type: Article
Times cited : (126)

References (133)
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    • Erratum: Systematic study of basis set superposition errors in the calculated interaction energy of two HF molecules [J. Chem. Phys. 82, 2418 (1985)]
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    • Schwenke1    Truhlar2
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    • 84890021933 scopus 로고
    • The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors
    • (1970) Molecular Physics , vol.19 , pp. 553
    • Boys1    Bernardi2
  • 57
    • 24444467700 scopus 로고
    • Weak interactions between small systems. Models for studying the nature of intermolecular forces and challenging problems for ab initio calculations
    • (1988) Chemical Reviews , vol.88 , pp. 943
    • Chalasiński1    Gutowski2
  • 62
    • 0010762391 scopus 로고
    • An SCF-CI study of the water dimer potential surface and the effects of including the correlation energy, the basis set superposition error and the Davidson correction
    • (1985) Molecular Physics , vol.55 , pp. 1097
    • Baum1    Finney2
  • 68
    • 84947142304 scopus 로고
    • On the connection between the supermolecular Møller-Plesset treatment of the interaction energy and the perturbation theory of intermolecular forces
    • (1988) Molecular Physics , vol.63 , pp. 205
    • Chalasiński1    Szcześniak2
  • 101
  • 132
    • 36449006688 scopus 로고
    • Potential energy surfaces, quasiadiabatic channels, rovibrational spectra, and intramolecular dynamics of (HF)2 and its isotopomers from quantum Monte Carlo calculations
    • (1991) The Journal of Chemical Physics , vol.95 , pp. 28
    • Quack1    Suhm2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.