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Bond Indices in Solids: Extended Analytical Model

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F67985858%3A_____%2F11%3A00363294" target="_blank" >RIV/67985858:_____/11:00363294 - isvavai.cz</a>

  • Result on the web

    <a href="http://dx.doi.org/10.1002/jcc.21898" target="_blank" >http://dx.doi.org/10.1002/jcc.21898</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1002/jcc.21898" target="_blank" >10.1002/jcc.21898</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    Bond Indices in Solids: Extended Analytical Model

  • Original language description

    The analytical model suggested some time ago for the calculation of bond indices in infinite periodical structures was reconsidered and extended so as to provide not only realistic estimate of the extent of electron sharing localized among individual pairs of the atoms in the lattice but also to detect the eventual presence of multicenter bonding in metallic solids.

  • 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

    <a href="/en/project/GA203%2F09%2F0118" target="_blank" >GA203/09/0118: Modern theoretical tools for the analysis of chemical bonding</a><br>

  • 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 Computational Chemistry

  • ISSN

    0192-8651

  • e-ISSN

  • Volume of the periodical

    32

  • Issue of the periodical within the volume

    14

  • Country of publishing house

    US - UNITED STATES

  • Number of pages

    8

  • Pages from-to

    3114-3121

  • UT code for WoS article

    000295123000019

  • EID of the result in the Scopus database