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Volumn 93, Issue 14, 1997, Pages 2355-2359

Quadratic complete basis set ab initio and hybrid density functional theory studies of the stability of HNC, HCN, H2NCH and HNCH2, their isomerizations, and the hydrogen insertion reactions for HCN and HNC

Author keywords

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Indexed keywords


EID: 33748627433     PISSN: 09565000     EISSN: None     Source Type: Journal    
DOI: 10.1039/a701165b     Document Type: Article
Times cited : (40)

References (54)
  • 2
    • 0003442182 scopus 로고
    • ed. J. K. Labanowski and J. W. Andzelm, Springer, New York
    • Density Functional Methods in Chemistry, ed. J. K. Labanowski and J. W. Andzelm, Springer, New York, 1991;
    • (1991) Density Functional Methods in Chemistry
  • 31
    • 0000250692 scopus 로고    scopus 로고
    • Computing Transition State Structures with Density Functional Theory Methods
    • ed. J. M. Seminario, Elsevier, Amsterdam
    • B. S. Jursic, Computing Transition State Structures with Density Functional Theory Methods, in Recent Developments and Applications of Modern Density Functional Theory, ed. J. M. Seminario, Elsevier, Amsterdam, 1996.
    • (1996) Recent Developments and Applications of Modern Density Functional Theory
    • Jursic, B.S.1
  • 32
    • 33748613986 scopus 로고    scopus 로고
    • Exploring Reaction Outcomes Through the Reactivity-Selectivity Principle Estimated by Density Functional Theory Studies
    • ed. W. C. Herndon and C. Parkanyi, Elsevier, Amsterdam, in press
    • B. S. Jursic, Exploring Reaction Outcomes Through the Reactivity-Selectivity Principle Estimated by Density Functional Theory Studies, in Theoretical Organic Chemistry, ed. W. C. Herndon and C. Parkanyi, Elsevier, Amsterdam, in press.
    • Theoretical Organic Chemistry
    • Jursic, B.S.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.