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  1. TitleNLO responses of small polymethineimine oligomers: A CCSD(T) study
    Par.titleNLO odozvy malých polymetylénimínových oligomérov: CCSD(T) štúdia
    Author infoMiroslav Medveď ... [et al.]
    Co-authors Medveď Miroslav 1971- (30%%) UMBFP08 - Katedra chémie
    Another authors Noga Jozef (Author) (30%%)
    Jacquemin Denis (Author) (20%%)
    Assfeld Xavier (Author) (10%%)
    Perpéte Eric A. (Author) (10%%)
    Source document Journal of Molecular Structure : THEOCHEM. Vol. 821, no. 1-3 (2007), pp. 160-165. - Amsterdam : Elsevier B.V., 2007
    Keywords NLO vlastnosti - NLO properties   polymetylénimín   hyperpolarizovateľnosť   CCSD(T) metóda   NLO properties   hyperpolarizability   polymethineimine  
    LanguageEnglish
    CountryNetherlands
    systematics 54
    Public work category ADC
    No. of Archival Copy6791
    Repercussion category KRAWCZYK, Przemyslaw. DFT study of linear and nonlinear optical properties of donor-acceptor substituted stilbenes, azobenzenes and benzilideneanilines. In Journal of molecular modeling. ISSN 1610-2940, 2010, vol. 16, no. 4, pp. 659-668.
    HERNANDEZ-PAREDES, J. - GLOSSMAN-MITNIK, Daniel - DUARTE-MOLLER, A. - FLORES-HOLGUIN, N. Theoretical calculations of molecular dipole moment, polarizability, and first hyperpolarizability of glycine-sodium nitrate. In Journal of molecular structure-Theochem. ISSN 0166-1280, 2009, vol. 905, no. 1-3, pp. 76-80.
    AMALANATHAN, M. - XAVIER, T.S. - JOE, I. Hubert - RASTOGI, V.K. Normal coordinate analysis and nonlinear optical response of cross-conjugated system 4,4-dimethyl benzophenone. In Spectrochimica acta part A : molecular and biomolecular spectroscopy. ISSN 1386-1425, 2013, vol. 116, pp. 574-583.
    BULIK, Ireneusz W. - ZALESNY, Robert - BARTKOWIAK, Wojciech et al. Performance of density functional theory in computing nonresonant vibrational (hyper)polarizabilities. In Journal of computational chemistry. ISSN 0192-8651, 2013, vol. 34, no. 20, pp. 1775-1784.
    Catal.org.BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici
    Databasexpca - PUBLIKAČNÁ ČINNOSŤ
    ReferencesPERIODIKÁ-Súborný záznam periodika
  2. TitleElectronic NLO properties of cyanoborane monomers
    Author infoMiroslav Medveď... [et al.]
    Co-authors Medveď Miroslav 1971- UMBFP08 - Katedra chémie
    Another authors Černušák Ivan (Author)
    Kedžuch Stanislav (Author)
    Noga Jozef (Author)
    Source documentModelling and Design of Molecular Materials : program book of abstracts : workshop Wroclaw, Poland September 16-20, 2004. S. [1 s.]. -, 2004
    Keywords NLO properties   NLO vlastnosti - NLO properties  
    LanguageEnglish
    CountryPoland
    systematics 54
    Public work category AFK
    No. of Archival Copy3612
    Catal.org.BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici
    Databasexpca - PUBLIKAČNÁ ČINNOSŤ


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