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  <front xmlns:xlink="http://www.w3.org/1999/xlink">
    <journal-meta>
      <journal-id journal-id-type="elibrary">https://www.elibrary.ru/title_about_new.asp?i</journal-id>
      <journal-title-group>
        <journal-title>Materials physics and mechanics</journal-title>
        <trans-title-group xml:lang="ru">
          <trans-title>Механика и физика материалов</trans-title>
        </trans-title-group>
      </journal-title-group>
      <issn pub-type="epub">1605-8119</issn>
    </journal-meta>
    <article-meta xmlns:xlink="http://www.w3.org/1999/xlink">
      <article-id pub-id-type="publisher-id">11</article-id>
      <title-group>
        <article-title>Disclinated rings as structural units in MD simulation of intercrystallite boundaries in graphene</article-title>
        <trans-title-group xml:lang="ru">
          <trans-title>Disclinated rings as structural units in MD simulation of intercrystallite boundaries in graphene</trans-title>
        </trans-title-group>
      </title-group>
      <contrib-group>
        <contrib contrib-type="author">
          <name>
            <surname>Rozhkov</surname>
          </name>
          <xref ref-type="aff" rid="aff1"/>
        </contrib>
        <contrib contrib-type="author">
          <contrib-id contrib-id-type="orcid">0000-0003-4116-4821</contrib-id>
          <contrib-id contrib-id-type="scopus">7005519053</contrib-id>
          <contrib-id contrib-id-type="researcherid">N-7717-2016</contrib-id>
          <name>
            <surname>Kolesnikova</surname>
            <given-names>Anna</given-names>
          </name>
          <xref ref-type="aff" rid="aff2"/>
          <email>anna.kolesnikova.physics@gmail.com</email>
        </contrib>
        <contrib contrib-type="author">
          <name>
            <surname>Orlova</surname>
            <given-names>T.S.</given-names>
          </name>
          <xref ref-type="aff" rid="aff3"/>
        </contrib>
        <contrib contrib-type="author">
          <name>
            <surname>Zhigilei</surname>
          </name>
          <xref ref-type="aff" rid="aff4"/>
        </contrib>
        <contrib contrib-type="author">
          <contrib-id contrib-id-type="orcid">0000-0003-3738-408X</contrib-id>
          <contrib-id contrib-id-type="scopus">7202768874</contrib-id>
          <contrib-id contrib-id-type="researcherid">F-1445-2014</contrib-id>
          <name>
            <surname>Romanov</surname>
            <given-names>Alexey</given-names>
          </name>
          <xref ref-type="aff" rid="aff1"/>
          <email>alexey.romanov@niuitmo.ru</email>
        </contrib>
      </contrib-group>
      <aff id="aff1">ITMO University</aff>
      <aff id="aff2">Institute of Problems of Mechanical Engineering RAS</aff>
      <aff id="aff3">Ioffe Institute</aff>
      <aff id="aff4">University of Virginia</aff>
      <pub-date publication-format="electronic" date-type="pub" iso-8601-date="2016-12-03">
        <day>03</day>
        <month>12</month>
        <year>2016</year>
      </pub-date>
      <volume>29</volume>
      <issue>1</issue>
      <fpage>101</fpage>
      <lpage>105</lpage>
      <self-uri xmlns:xlink="http://www.w3.org/1999/xlink" content-type="pdf" xlink:href="https://mpm.spbstu.ru/userfiles/files/MPM129_11_rozhkov.pdf"/>
      <abstract xml:lang="en">
        <p>In this paper, we present a method of assembling intercrystallite boundaries in graphene from well-defined structural units containing the multipoles of non-hexagonal carbon rings (disclinations). We demonstrate that two types of intercrystallite boundaries are possible in graphene: those with misorientation between neighboring regions of the crystal and the others with a zero angle of misorientation. The misorientation is controlled by the type of disclination multipoles composing the intercrystallite boundaries. The energies of "5-8-5" boundaries, consisting of pentagonal and octagonal carbon rings, are calculated by molecular dynamics simulations.</p>
      </abstract>
      <kwd-group xml:lang="en">
        <kwd>graphene</kwd>
        <kwd>intercrystallite boundaries</kwd>
        <kwd>structural units</kwd>
        <kwd>carbon rings</kwd>
        <kwd>disclination</kwd>
      </kwd-group>
    </article-meta>
  </front>
</article>
