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Peculiarities of the Environmental Influence on the Optical Properties of Push-Pull Nonlinear Optical Molecules: A Theoretical Study

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216275%3A25310%2F11%3A39892108" target="_blank" >RIV/00216275:25310/11:39892108 - isvavai.cz</a>

  • Result on the web

    <a href="http://dx.doi.org/10.1021/jp2013539" target="_blank" >http://dx.doi.org/10.1021/jp2013539</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1021/jp2013539" target="_blank" >10.1021/jp2013539</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    Peculiarities of the Environmental Influence on the Optical Properties of Push-Pull Nonlinear Optical Molecules: A Theoretical Study

  • Original language description

    In this work we present the theoretical investigations of the UV-vis absorption spectra of the imidazole-derived push-pull molecules. The geometries of all molecules were optimized in the gas phase (in a vacuum) and then the electronic properties were affected by solvents.

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

  • CEP classification

    CF - Physical chemistry and theoretical chemistry

  • OECD FORD branch

Result continuities

  • Project

  • Continuities

    Z - Vyzkumny zamer (s odkazem do CEZ)

Others

  • Publication year

    2011

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Journal of Physical Chemistry A

  • ISSN

    1089-5639

  • e-ISSN

  • Volume of the periodical

    115

  • Issue of the periodical within the volume

    44

  • Country of publishing house

    US - UNITED STATES

  • Number of pages

    8

  • Pages from-to

    12251-12258

  • UT code for WoS article

    000296393500022

  • EID of the result in the Scopus database