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Title Relation between nonlinear optical properties of push-pull molecules and metric of charge transfer excitations Author info Nanna Holmgaard List ... [et al.] Author List Holmgaard Nanna (25%)
Co-authors Zaleśny Robert 1977- (15%) UMBFP08 - Katedra chémie
Murugan N. Arul (15%)
Kongsted Jacob (15%)
Bartkowiak Wojciech (15%)
Ågren Hans (15%)
Source document Journal of Chemical Theory and Computation. Vol. 11, no. 9 (2015), pp. 4182-4188. - Washington : The American Chemical Society, 2015 Keywords nelineárne optické vlastnosti excitácia s prenosom náboja nonlinear optical properties charge transfer excitations Language English Country Switzerland systematics 544 Public work category ADC No. of Archival Copy 34756 Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ References PERIODIKÁ-Súborný záznam periodika Title Comparison of property-oriented basis sets for the computation of electronic and nuclear relaxation hyperpolarizabilities Author info Robert Zaleśny ... [et al.] Author Zaleśny Robert 1977- (40%) UMBFP08 - Katedra chémie
Co-authors Baranowska-Laczkowska Angelika (20%)
Medveď Miroslav 1971- (20%) UMBFP08 - Katedra chémie
Luis Josep M. (20%)
Source document Journal of Chemical Theory and Computation. Vol. 11, no. 9 (2015), pp. 4119-4128. - Washington : The American Chemical Society, 2015 Keywords hyperpolarizovateľnosť atómové bázy vibračné príspevky hyperpolarizability atomic basis sets vibrational contributions Language English Country United States of America systematics 543 Public work category ADC No. of Archival Copy 34751 Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ References PERIODIKÁ-Súborný záznam periodika