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Friction Sensitivity of Nitramines. Part IV: Links to Surfaře Electrostatic Potentials

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216275%3A25310%2F11%3A39892490" target="_blank" >RIV/00216275:25310/11:39892490 - isvavai.cz</a>

  • Result on the web

  • DOI - Digital Object Identifier

Alternative languages

  • Result language

    angličtina

  • Original language name

    Friction Sensitivity of Nitramines. Part IV: Links to Surfaře Electrostatic Potentials

  • Original language description

    The friction sensitivities (FS) of five aliphatic linear and eight cyclic nitramines have been determined and correlated with DFT B3LYP/6-31-G(d,p) // 6-311+G(d,p) positive (VS,max) and negative (VS,min) extremes of molecular surface electrostatic potentials VS(r). While there is an ambiguous relationship between the VS,max values and FS values, the decrease of FS is associated (more or less) with an increase in VS,min values.

  • 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

    HanNeng CaiLiao (Chinese Journal of Energetic Materials)

  • ISSN

    1006-9941

  • e-ISSN

  • Volume of the periodical

    19

  • Issue of the periodical within the volume

    6

  • Country of publishing house

    CN - CHINA

  • Number of pages

    3

  • Pages from-to

    613-615

  • UT code for WoS article

  • EID of the result in the Scopus database