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Relationships between electronic charges at nitrogen atoms of primarily split off nitro groups and detonation characteristics of some m-dinitrobenzopolyazaarenes

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216305%3A26310%2F01%3APU22164" target="_blank" >RIV/00216305:26310/01:PU22164 - isvavai.cz</a>

  • Result on the web

  • DOI - Digital Object Identifier

Alternative languages

  • Result language

    angličtina

  • Original language name

    Relationships between electronic charges at nitrogen atoms of primarily split off nitro groups and detonation characteristics of some m-dinitrobenzopolyazaarenes

  • Original language description

    Electronic charges q at nitrogen atoms of twelve dinitrobenzopolyazaarenes were calculated by means of ab initio HF/6-31G** and semiempirical AM1 methods. The relationships have been confirmed between squares of detonation velocities or, as the case maybe, the detonation heats of the arenes and q-values for primarily split off nitro groups.

  • Czech name

    Vztahy mezi elektronovými náboji dusikového atomu primárně odstupujících nitroskupin a detonačními charakteristikami některých m-dinitrobenzopolyazaarenů.

  • Czech description

    Elektronové náboje dusíkových atomů primárně odstupujících nitroskupin některých m-dinitrobenzopolyazaarenů, vypočtené AM1 a HF/6-31G** metodami, byly korelovány s jejich detonačními charakteristikami.

Classification

  • Type

    D - Article in proceedings

  • 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

    2001

  • Confidentiality

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

Data specific for result type

  • Article name in the collection

    Proceedings of the 4th Seminar New trends in research of energetic materials

  • ISBN

    80-7194-333-9

  • ISSN

  • e-ISSN

  • Number of pages

    13

  • Pages from-to

    131-143

  • Publisher name

    University Pardubice

  • Place of publication

    Pardubice

  • Event location

    Pardubice

  • Event date

    Apr 11, 2001

  • Type of event by nationality

    WRD - Celosvětová akce

  • UT code for WoS article