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Volumn 17, Issue 1, 1996, Pages 49-56

Using redundant internal coordinates to optimize equilibrium geometries and transition states

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Indexed keywords


EID: 2442481958     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(19960115)17:1<49::AID-JCC5>3.0.CO;2-0     Document Type: Article
Times cited : (2750)

References (29)
  • 1
    • 0003418036 scopus 로고
    • D. R. Yarkony, Ed., World Scientific Publishing, Singapore
    • (a) H. B. Schlegel, In Modern Electronic Structure Theory, D. R. Yarkony, Ed., World Scientific Publishing, Singapore, 1995
    • (1995) Modern Electronic Structure Theory
    • Schlegel, H.B.1
  • 9
    • 84988122931 scopus 로고
    • J. Simons and J. Nichols, Int. J. Quantum Chem. Quantum Chem. Symp., 24, 263 (1990) and references therein; present implementation from J. Baker, J. Comp. Chem., 7, 385 (1986).
    • (1986) J. Comp. Chem. , vol.7 , pp. 385
    • Baker, J.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.