LEADER 02863oam 2200505 450 001 9910298533203321 005 20190911112726.0 010 $a3-642-41272-6 024 7 $a10.1007/978-3-642-41272-1 035 $a(OCoLC)863155249 035 $a(MiFhGG)GVRL6WRB 035 $a(EXLCZ)992550000001152692 100 $a20140423d2014 uy 0 101 0 $aeng 135 $aurun|---uuuua 181 $ctxt 182 $cc 183 $acr 200 10$a8th Congress on Electronic Structure $ePrinciples and Applications (ESPA 2012) : a conference selection from theoretical chemistry accounts /$fJuan J. Novoa, Manuel F. Ruiz-Lopez, volume editors ; with contributions from Manuel Alcami [and eighty-four others] 205 $a1st ed. 2014. 210 1$aHeidelberg, Germany :$cSpringer,$d2014. 215 $a1 online resource (vi, 230 pages) $cillustrations (chiefly color) 225 1 $aHighlights in Theoretical Chemistry,$x2194-8666 ;$v5 300 $a"ISSN: 2194-8666." 300 $a"ISSN: 2194-8674 (electronic)." 311 $a3-642-41271-8 320 $aIncludes bibliographical references. 327 $aFrom the Contents: Analysis of the origin of lateral interactions in the adsorption of small organic molecules on oxide surfaces -- First-principles study of structure and stability in Si?C?O-based materials -- A time-dependent DFT/molecular dynamics study of the proton-wire responsible for the red fluorescence in the LSSmKate2 protein -- Preface to the ESPA-2012 special issue. 330 $aThis volume collects research findings presented at the 8th Edition of the Electronic Structure: Principles and Applications (ESPA-2012) International Conference, held in Barcelona, Spain on June 26-29, 2012. The contributions cover research work on methods and fundamentals of theoretical chemistry, chemical reactivity, bimolecular modeling, and materials science. Originally published in the journal Theoretical Chemistry Accounts, these outstanding papers are now available in a hardcover print format, as well as a special electronic edition. This volume provides valuable content for all researchers in theoretical chemistry, and will especially benefit those research groups and libraries with limited access to the journal. 410 0$aHighlights in Theoretical Chemistry,$x2194-8666 ;$v5 606 $aElectronic structure$vCongresses 606 $aChemistry, Physical and theoretical$vCongresses 615 0$aElectronic structure 615 0$aChemistry, Physical and theoretical 676 $a530.4 676 $a541.2 702 $aNovoa$b Juan J. 702 $aRuiz-Lopez$b M. F$g(Manuel F.), 702 $aAlcami$b Manuel 801 0$bMiFhGG 801 1$bMiFhGG 906 $aBOOK 912 $a9910298533203321 996 $a8th Congress on Electronic Structure$93871305 997 $aUNINA