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  1. TitleCritical analysis of spectral solvent shifts calculated by different PCM approaches of representative series of charge-transfer complexes between TCNE and methylated benzenes
    Author infoŠimon Budzák, Ondrej Kyseľ, Miroslav Medveď, Pavel Mach
    Author Budzák Šimon 1982- (25%) UMBFP08 - Katedra chémie
    Co-authors Kyseľ Ondrej 1937- (25%) UMBFP08 - Katedra chémie
    Medveď Miroslav 1971- (25%) UMBFP08 - Katedra chémie
    Mach Pavel (25%)
    Source document Advances in computational spectroscopy (CODECS 2014) : workshop CMST Action CM1002-CODECS, October 23-27, 2014 Bratislava : book of abstracts. S. 111. - Banská Bystrica : Matej Bel University, 2014 / Medveď Miroslav 1971- ; Advances in computational spectroscopy (CODECS 2014) workshop
    Keywords PCM solvent efekty   PCM solvent effects   TCNE  
    LanguageEnglish
    CountrySlovak Republic
    systematics 54
    Public work category AFH
    No. of Archival Copy32027
    Catal.org.BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici
    Databasexpca - PUBLIKAČNÁ ČINNOSŤ
    unrecognised

    unrecognised

  2. TitleComputational study of CT excitations in methylated benzenes – TCNE complexes
    Author infoŠimon Budzák ... [et al.]
    Author Budzák Šimon 1982- (25%) UMBFP08 - Katedra chémie
    Co-authors Mach Pavel (25%)
    Medveď Miroslav 1971- (25%) UMBFP08 - Katedra chémie
    Kyseľ Ondrej 1937- (25%) UMBFP08 - Katedra chémie
    Source document 11-th Central European Symposium on Theoretical Chemistry : September 2 - 5, 2012 Mariapharr, Austria : conference book. S. 17. - Graz : University of Graz, 2012 ; 11-th Central European Symposium on Theoretical Chemistry European symposium
    Keywords excitácia s prenosom náboja   TCNE   metylbenzény   methylbenzenes  
    LanguageEnglish
    CountryAustria
    systematics 54
    Public work category BFA
    No. of Archival Copy23336
    Catal.org.BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici
    Databasexpca - PUBLIKAČNÁ ČINNOSŤ
    unrecognised

    unrecognised



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