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On the optimization of the DF-SAPT-DFT interaction energies of hydrogen-bonded systems

  1. 1.
    SYSNO0329037
    TitleOn the optimization of the DF-SAPT-DFT interaction energies of hydrogen-bonded systems
    TitleOptimalizace DF-SAPT-DFT interakčních energií systémů s vodíkovými vazbami
    Author(s) Czernek, Jiří (UMCH-V) RID
    Source Title Proceedings of the 5th WSEAS International Symposium on Simulation, Modelling and Optimization. S. 237-241. - Budapest : World Scientific and Engineering Academy and Society, 2009 / Rudas I. ; Demiralp M. ; Mastorakis N.
    Conference WSEAS International Symposium on Simulation, Modelling and Optimization /9./, Budapest, 03.09.2009-05.09.2009
    Document TypeKonferenční příspěvek (zahraniční konf.)
    Grant IAA400500602 GA AV ČR - Academy of Sciences of the Czech Republic (AV ČR)
    2B08021 GA MŠMT - Ministry of Education, Youth and Sports (MEYS)
    CEZAV0Z40500505 - UMCH-V (2005-2011)
    Languageeng
    CountryHU
    Keywords optimization * ab initio * DFT * interaction energy
    URL http://www.wseas.us/books/2009/budapest/SMO.pdf
    Permanent Linkhttp://hdl.handle.net/11104/0175178
     
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