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On the optimization of the DF-SAPT-DFT interaction energies of hydrogen-bonded systems
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SYSNO 0329037 Title On the optimization of the DF-SAPT-DFT interaction energies of hydrogen-bonded systems Title Optimalizace 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 Type Konferenční 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) CEZ AV0Z40500505 - UMCH-V (2005-2011) Language eng Country HU Keywords optimization * ab initio * DFT * interaction energy URL http://www.wseas.us/books/2009/budapest/SMO.pdf Permanent Link http://hdl.handle.net/11104/0175178
Number of the records: 1