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Volumn 84, Issue 1, 2010, Pages 39-43

The applicability of TD-DFT methods to calculations of the electronic absorption spectrum of hexaamminoruthenium(II) in aqueous solution

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION BAND; AQUEOUS SOLUTIONS; DENSITY FUNCTIONAL THEORY METHODS; DFT METHOD; ELECTRONIC ABSORPTION SPECTRA; EXCHANGE POTENTIALS; EXCHANGE-CORRELATION FUNCTIONALS; INTENSE BANDS; LIGAND-FIELD; NONSTATIONARY; TIME-DEPENDENT DFT;

EID: 77649119469     PISSN: 00360244     EISSN: None     Source Type: Journal    
DOI: 10.1134/S0036024410010085     Document Type: Article
Times cited : (6)

References (11)
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    • 10.1021/cr0505627 1:CAS:528:DC%2BD2MXhtVKmtLrK
    • A. Dreuw M. Head-Gordon 2005 Chem. Rev. 105 4009 10.1021/cr0505627 1:CAS:528:DC%2BD2MXhtVKmtLrK
    • (2005) Chem. Rev. , vol.105 , pp. 4009
    • Dreuw, A.1    Head-Gordon, M.2
  • 4
    • 2542450086 scopus 로고    scopus 로고
    • 10.1063/1.1688752 1:CAS:528:DC%2BD2cXjsVKkurY%3D
    • Y. Tawada T. Tsuneda S. Yanagisawa 2004 J. Chem. Phys. 120 8425 10.1063/1.1688752 1:CAS:528:DC%2BD2cXjsVKkurY%3D
    • (2004) J. Chem. Phys. , vol.120 , pp. 8425
    • Tawada, Y.1    Tsuneda, T.2    Yanagisawa, S.3
  • 8
    • 0000138517 scopus 로고    scopus 로고
    • 10.1063/1.472045 1:CAS:528:DyaK28Xks1yktrY%3D
    • P. Day J. Jensen M. Gordon S. Webb 1996 J. Chem. Phys. 105 1968 10.1063/1.472045 1:CAS:528:DyaK28Xks1yktrY%3D
    • (1996) J. Chem. Phys. , vol.105 , pp. 1968
    • Day, P.1    Jensen, J.2    Gordon, M.3    Webb, S.4
  • 10
    • 77649178390 scopus 로고    scopus 로고
    • http://classic/chem.msu.su/gran/games/index.html.
  • 11
    • 84893169025 scopus 로고
    • 10.1002/jcc.540141112 1:CAS:528:DyaK2cXhsFaqtQ%3D%3D
    • M. Schmidt K. Baldridge J. Boatz, et al. 1993 J. Comput. Chem. 14 1347 10.1002/jcc.540141112 1:CAS:528:DyaK2cXhsFaqtQ%3D%3D
    • (1993) J. Comput. Chem. , vol.14 , pp. 1347
    • Schmidt, M.1    Baldridge, K.2    Boatz, J.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.