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Volumn 105, Issue 19-22, 2007, Pages 2793-2798

Structure and binding energies of the porphine dimer

Author keywords

Density functional theory; Dispersion correction; Porphine; SCS MP2; Van der Waals complex

Indexed keywords

BINDING ENERGY; COULOMB INTERACTIONS; DENSITY FUNCTIONAL THEORY; MONOMERS; OPTIMIZATION; VAN DER WAALS FORCES;

EID: 38849142022     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970701635543     Document Type: Article
Times cited : (30)

References (49)
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    • R. Ahlrichs, M. Bär, H.-P. Baron, R. Bauernschmitt, S. Böcker, N. Crawford, P. Deglmann, M. Ehrig, K. Eichkorn, S. Elliott, F. Furche, F. Haase, M. Häser, C. Hättig, A. Hellweg, H. Horn, C. Huber, U. Huniar, M. Kattannek, A. Köhn, C. Kölmel, M. Kollwitz, K. May, P. Nava, C. Ochsenfeld, H. Öhm, H. Patzelt, D. Rappoport, O. Rubner, A. Schäfer, U. Schneider, M. Sierka, O. Treutler, B. Unterreiner, M. von Arnim, F. Weigend, P. Weis, and H. Weiss. TURBOMOLE, version 5.9 Universität Karlsruhe, Karlsruhe, 2003, see
    • R. Ahlrichs, M. Bär, H.-P. Baron, R. Bauernschmitt, S. Böcker, N. Crawford, P. Deglmann, M. Ehrig, K. Eichkorn, S. Elliott, F. Furche, F. Haase, M. Häser, C. Hättig, A. Hellweg, H. Horn, C. Huber, U. Huniar, M. Kattannek, A. Köhn, C. Kölmel, M. Kollwitz, K. May, P. Nava, C. Ochsenfeld, H. Öhm, H. Patzelt, D. Rappoport, O. Rubner, A. Schäfer, U. Schneider, M. Sierka, O. Treutler, B. Unterreiner, M. von Arnim, F. Weigend, P. Weis, and H. Weiss. TURBOMOLE, version 5.9 (Universität Karlsruhe, Karlsruhe, 2003), see http://www.turbomole.com.
  • 46
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    • edited by K. B. Lipkowitz and D. B. Boyd Wiley-VCH, New York
    • F. M. Bickelhaupt and E. J. Baerends, in Reviews in Computational Chemistry, edited by K. B. Lipkowitz and D. B. Boyd (Wiley-VCH, New York, 2000), Vol. 15, pp. 1-86.
    • (2000) Reviews in Computational Chemistry , vol.15 , pp. 1-86
    • Bickelhaupt, F.M.1    Baerends, E.J.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.