Interaction of solitons on 2‐dimensional branched π‐electron surface of graphene ribbons

Sendiuk Volodymyr A.; Pavlenko Elena L.; Dmytrenko Oksana P.; Kulish Mykola P.; Viniychuk Oleksandr O.; Prostota Yaroslav O.; Kachkovsky Olexiy D.

摘要

Abstract > We have performed quantum‐mechanical study of charge distribution on the carbon atoms of two‐dimensional conjugated system of the model graphene ribbon. The study shows that charges in the quasi‐two dimensional conjugated system of the graphene ribbon are not localized on separate carbon atoms, but form one‐dimensional solitonic charge waves along zig‐zag sides. There are two solitonic charge waves in the dication or dication due to generation of own soliton by each charge; the first soliton in the acene chain is located on one side while the second one is positioned on the opposite side. The shapes of the solitonic waves in the graphene ribbon are similar to ones in one‐dimensional conjugated systems. Similarly, in the ionic two‐dimensional collective systems of π‐electrons two splitted solitonic levels are generated; lengthening of the chain leads to convergence of the levels. The widening of graphene ribbon ( y ‐expansion of two‐dimensional conjugated system is accompanied with recession of both solitons to outer sides, so amplitudes of the solitons on the inner sides regularly decrease under widening of the model graphene ribbon; the charges on the inner carbon atoms converge to zero. </abstract> </span> <span class="z_kbtn z_kbtnclass hoverxs" style="display: none;">展开▼</span> </div> <div class="translation abstracttxt"> <span class="zhankaihshouqi fivelineshidden" id="abstract"> <span>机译：</span><Abstract Type =“main”> <标题类型=“main”>抽象</标题> >我们已经对模型石墨烯带的二维共轭系统的碳原子进行了量子机械研究。该研究表明，石墨烯带的准二维共轭系统中的电荷未在单独的碳原子上局部，但是沿着锯齿侧形成一维溶液电荷波。通过每次电荷产生自身孤独的产生，存在两种棒子电荷波浪;丙烯链中的第一孤子位于一侧，同时第二个位于相对的侧面。石墨烯带中的棒状波的形状与一维共轭系统中的棒状波的形状类似。类似地，在π电子的离子二维集体系统中产生两个分裂溶度水平;链条的延长导致水平的收敛性。石墨烯带的加宽（ Y </ i>的二维共轭系统的扩展伴随着两个孤子到外侧的衰退，所以在模型石墨烯的加宽下，内侧的孤子上的孤子的振荡通常会降低功能区;内碳原子上的电荷会聚到零。</ p> </ abstract> </span> <span class="z_kbtn z_kbtnclass hoverxs" style="display: none;">展开▼</span> </div> </div> <div class="record"> <h2 class="all_title" id="enpatent33" >著录项</h2> <ul> <li> <span class="lefttit">来源</span> <div style="width: 86%;vertical-align: text-top;display: inline-block;"> <a href='/journal-foreign-21753/'>《International Journal of Quantum Chemistry》</a> <b style="margin: 0 2px;">|</b><span>2018年第2期</span><b style="margin: 0 2px;">|</b><span>共11页</span> </div> </li> <li> <div class="author"> <span class="lefttit">作者</span> <p id="fAuthorthree" class="threelineshidden zhankaihshouqi"> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Sendiuk Volodymyr A.&option=202" target="_blank" rel="nofollow">Sendiuk Volodymyr A.;</a> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Pavlenko Elena L.&option=202" target="_blank" rel="nofollow">Pavlenko Elena L.;</a> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Dmytrenko Oksana P.&option=202" target="_blank" rel="nofollow">Dmytrenko Oksana P.;</a> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Kulish Mykola P.&option=202" target="_blank" rel="nofollow">Kulish Mykola P.;</a> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Viniychuk Oleksandr O.&option=202" target="_blank" rel="nofollow">Viniychuk Oleksandr O.;</a> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Prostota Yaroslav O.&option=202" target="_blank" rel="nofollow">Prostota Yaroslav O.;</a> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Kachkovsky Olexiy D.&option=202" target="_blank" rel="nofollow">Kachkovsky Olexiy D.;</a> </p> <span class="z_kbtnclass z_kbtnclassall hoverxs" id="zkzz" style="display: none;">展开▼</span> </div> </li> <li> <div style="display: flex;"> <span class="lefttit">作者单位</span> <div style="position: relative;margin-left: 3px;max-width: 639px;"> <div class="threelineshidden zhankaihshouqi" id="fOrgthree"> <p>Department of Functional Materials PhysicsFaculty of Physics Taras Shevchenko National University of Kyiv64/13 Volodymyrska str Kyiv 01601 Ukraine;</p> <p>Department of Functional Materials PhysicsFaculty of Physics Taras Shevchenko National University of Kyiv64/13 Volodymyrska str Kyiv 01601 Ukraine;</p> <p>Department of Functional Materials PhysicsFaculty of Physics Taras Shevchenko National University of Kyiv64/13 Volodymyrska str Kyiv 01601 Ukraine;</p> <p>Department of Functional Materials PhysicsFaculty of Physics Taras Shevchenko National University of Kyiv64/13 Volodymyrska str Kyiv 01601 Ukraine;</p> <p>Department of Chemistry of Bioactive Nitrogen Containing Heterocyclic BasesInstitute of Bioorganic Chemistry and Petrochemistry of the National Academy of Sciences1 Murmanska street Kyiv 02660 Ukraine;</p> <p>Department of Chemistry of Bioactive Nitrogen Containing Heterocyclic BasesInstitute of Bioorganic Chemistry and Petrochemistry of the National Academy of Sciences1 Murmanska street Kyiv 02660 Ukraine;</p> <p>Department of Chemistry of Bioactive Nitrogen Containing Heterocyclic BasesInstitute of Bioorganic Chemistry and Petrochemistry of the National Academy of Sciences1 Murmanska street Kyiv 02660 Ukraine;</p> </div> <span class="z_kbtnclass z_kbtnclassall hoverxs" id="zhdw" style="display: none;">展开▼</span> </div> </div> </li> <li > <span class="lefttit">收录信息</span> <span style="width: 86%;vertical-align: text-top;display: inline-block;"></span> </li> <li> <span class="lefttit">原文格式</span> <span>PDF</span> </li> <li> <span class="lefttit">正文语种</span> <span>eng</span> </li> <li> <span class="lefttit">中图分类</span> <span><a href="https://www.zhangqiaokeyan.com/clc/1186.html" title="物理化学（理论化学）、化学物理学">物理化学（理论化学）、化学物理学;</a></span> </li> <li class="antistop"> <span class="lefttit">关键词</span> <p style="width: 86%;vertical-align: text-top;"> <a style="color: #3E7FEB;" href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=charge&option=203" rel="nofollow">charge;</a> <a style="color: #3E7FEB;" href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=electroconductivity&option=203" rel="nofollow">electroconductivity;</a> <a style="color: #3E7FEB;" href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=graphene ribbon&option=203" rel="nofollow">graphene ribbon;</a> <a style="color: #3E7FEB;" href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=organic molecules&option=203" rel="nofollow">organic molecules;</a> <a style="color: #3E7FEB;" href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=soliton&option=203" rel="nofollow">soliton;</a> </p> <div class="translation"> 机译：充电;导电性;石墨烯带;有机分子;孤子; </div> </li> </ul> </div> </div> <div class="literature cardcommon"> <div class="similarity "> <h3 class="all_title" id="enpatent66">相似文献</h3> <div class="similaritytab clearfix"> <ul> <li class="active" >外文文献</li> <li >中文文献</li> <li >专利</li> </ul> </div> <div class="similarity_details"> <ul > <li> <div> <b>1. </b><a class="enjiyixqcontent" 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