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<article article-type="research-article" dtd-version="1.3" xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xml:lang="ru"><front><journal-meta><journal-id journal-id-type="publisher-id">vestvfu</journal-id><journal-title-group><journal-title xml:lang="ru">Вестник Северо-Восточного федерального университета имени М. К. Аммосова</journal-title><trans-title-group xml:lang="en"><trans-title>Vestnik of North-Eastern Federal University</trans-title></trans-title-group></journal-title-group><issn pub-type="ppub">2222-5404</issn><issn pub-type="epub">2587-5620</issn><publisher><publisher-name>Северо-Восточный федеральный университет имени М.К. Аммосова</publisher-name></publisher></journal-meta><article-meta><article-id pub-id-type="doi">10.25587/2222-5404-2025-22-4-67-78</article-id><article-id custom-type="elpub" pub-id-type="custom">vestvfu-661</article-id><article-categories><subj-group subj-group-type="heading"><subject>Research Article</subject></subj-group><subj-group subj-group-type="section-heading" xml:lang="ru"><subject>ФИЗИЧЕСКИЕ НАУКИ</subject></subj-group><subj-group subj-group-type="section-heading" xml:lang="en"><subject>PHYSICAL SCIENCES</subject></subj-group></article-categories><title-group><article-title>Моделирование стационарных и осциллирующих дискретных бризеров в биатомном кристалле типа CsCl</article-title><trans-title-group xml:lang="en"><trans-title>Modeling of stationary and oscillating discrete breather in a CsCl type biatomic crystal</trans-title></trans-title-group></title-group><contrib-group><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0002-7298-0226</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Семёнова</surname><given-names>М. Н.</given-names></name><name name-style="western" xml:lang="en"><surname>Semenova</surname><given-names>M. N.</given-names></name></name-alternatives><bio xml:lang="ru"><p>СЕМЁНОВА Мария Николаевна – к. ф.-м. н., доц. каф. фундаментальной и прикладной математики</p><p>ResearcherID: AAD-2973-2020, Scopus ID: 57204979109</p><p>г. Мирный</p></bio><bio xml:lang="en"><p>Mariya N. SEMENOVA – Cand. of Sci. (Phys. and Math.), Associate Professor</p><p>ResearcherID: AAD-2973-2020, Scopus ID: 57204979109</p><p>Mirny</p></bio><email xlink:type="simple">mariya_semyonova86@mail.ru</email><xref ref-type="aff" rid="aff-1"/></contrib><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0002-8366-4819</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Бебихов</surname><given-names>Ю. В.</given-names></name><name name-style="western" xml:lang="en"><surname>Bebikhov</surname><given-names>Yu. V.</given-names></name></name-alternatives><bio xml:lang="ru"><p>БЕБИХОВ Юрий Владимирович – д. ф.-м. н., доц., зав. каф. электроэнергетики и автоматизации промышленного производства</p><p>ResearcherID: JCE6803-2023, Scopus ID: 35329263600</p><p>г. Мирный</p></bio><bio xml:lang="en"><p>Yuriy V. BEBIKHOV – Doct. of Sci. (Phys. and Math.), Associate Professor, Head of the Department of Electric Power Engineering and Industrial Automation</p><p>ResearcherID: JCE-6803-2023, Scopus ID: 35329263600</p><p>Mirny</p></bio><email xlink:type="simple">bebikhov.yura@mail.ru</email><xref ref-type="aff" rid="aff-1"/></contrib><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0002-0320-2797</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Наумов</surname><given-names>Е. К.</given-names></name><name name-style="western" xml:lang="en"><surname>Naumov</surname><given-names>E. K.</given-names></name></name-alternatives><bio xml:lang="ru"><p>НАУМОВ Евгений Константинович – аспирант</p><p>Scopus ID: 57798022700</p><p>г. Уфа</p></bio><bio xml:lang="en"><p>Evgeny K. NAUMOV – Graduate Student </p><p>Scopus ID: 57798022700</p><p>Ufa</p></bio><email xlink:type="simple">naumov.evg-k@net.ugatu.su</email><xref ref-type="aff" rid="aff-2"/></contrib><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0002-6744-4445</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Дмитриев</surname><given-names>С. В.</given-names></name><name name-style="western" xml:lang="en"><surname>Dmitriev</surname><given-names>S. V.</given-names></name></name-alternatives><bio xml:lang="ru"><p>ДМИТРИЕВ Сергей Владимирович – д. ф.-м. н., профессор, зав. лаб.</p><p>ResearcherID: M-95822013, Scopus ID: 7102791521</p><p>г. Уфа</p></bio><bio xml:lang="en"><p>Sergey V. DMITRIEV – Doct. of Sci. (Phys. and Math.), Professor, Head of laboratory</p><p>ResearcherID: M-9582-2013, Scopus ID: 7102791521</p><p>Ufa</p><p> </p></bio><email xlink:type="simple">dmitriev.sergey.v@gmail.com</email><xref ref-type="aff" rid="aff-2"/></contrib></contrib-group><aff-alternatives id="aff-1"><aff xml:lang="ru"><institution>Политехнический институт (филиал) Северо-Восточного федерального университета им. М.К. Аммосова,</institution><country>Россия</country></aff><aff xml:lang="en"><institution>Polytechnic Institute (branch) M.K. Ammosov North-Eastern Federal University in Mirny</institution><country>Russian Federation</country></aff></aff-alternatives><aff-alternatives id="aff-2"><aff xml:lang="ru"><institution>Институт физики молекул и кристаллов Уфимского федерального исследовательского центра Российской академии наук</institution><country>Россия</country></aff><aff xml:lang="en"><institution>Institute of Physics of Molecules and Crystals, Ufa Federal Research Center of the Russian Academy of Sciences</institution><country>Russian Federation</country></aff></aff-alternatives><pub-date pub-type="collection"><year>2025</year></pub-date><pub-date pub-type="epub"><day>12</day><month>01</month><year>2026</year></pub-date><volume>22</volume><issue>4</issue><fpage>67</fpage><lpage>78</lpage><permissions><copyright-statement>Copyright &amp;#x00A9; Семёнова М.Н., Бебихов Ю.В., Наумов Е.К., Дмитриев С.В., 2025</copyright-statement><copyright-year>2025</copyright-year><copyright-holder xml:lang="ru">Семёнова М.Н., Бебихов Ю.В., Наумов Е.К., Дмитриев С.В.</copyright-holder><copyright-holder xml:lang="en">Semenova M.N., Bebikhov Y.V., Naumov E.K., Dmitriev S.V.</copyright-holder><license xml:lang="ru" license-type="creative-commons-attribution" xlink:href="https://creativecommons.org/licenses/by/4.0/" xlink:type="simple"><license-p>Данная работа распространяется под лицензией Creative Commons Attribution 4.0.</license-p></license><license xml:lang="en" license-type="creative-commons-attribution" xlink:href="https://creativecommons.org/licenses/by/4.0/" xlink:type="simple"><license-p>This work is licensed under a Creative Commons Attribution 4.0 License.</license-p></license></permissions><self-uri xlink:href="https://vestvfu.elpub.ru/jour/article/view/661">https://vestvfu.elpub.ru/jour/article/view/661</self-uri><abstract><p>В настоящей работе исследуется моделирование стационарных и осциллирующих дискретных бризеров в биатомном кристалле типа CsCl с межатомными взаимодействиями, описываемыми потенциалом β-FPUT, при помощи методов молекулярной динамики. Дискретные бризеры (ДБ) – это пространственно локализованные колебания частиц в бездефектных нелинейных цепочках, которые могут существовать только в дискретных средах и нелинейных системах. Упорядоченные структуры типа CsCl относятся к кристаллам с объемно-центрированной кубической (ОЦК) решеткой, нелинейная динамика которых в последнее время привлекает высокий интерес и внимание исследователей. Представлена история открытия и эволюция исследований в изучении ДБ и делокализованных нелинейных колебательных мод (ДНКМ). Показан увеличивающийся интерес в изучении подвижных ДБ, способных переносить энергию по кристаллической решетке. Изображена расчетная ячейка ОЦК кристалла со структурой CsCl, где анализируется случай большой разницы в атомных массах компонентов. Показаны ДНКМ и ее частотная характеристика, где в фононном спектре кристалла возникает щель. Представлена частотная характерис- тика ДБ с жестким типом нелинейности, численно найденного в щели фононного спектра путем применения функции локализации к ДНКМ. Эта функция имеет вид гиперболи- ческого косинуса, что позволяет частоте ДБ с ростом амплитуды оторваться от нижней границы фононного спектра. В результате молекулярно-динамического моделирования в пакете LAMMPS получены ДБ, центрированные на атоме и между двумя соседними тяжелыми атомами. Показаны их движения, где атомы тяжелой подрешетки движутся с гораздо большими амплитудами, чем легкие атомы. Наконец, показаны временные зависимости стационарного ДБ, центрированного на атоме, и ДБ, осциллирующих вблизи этой конфигурации. Отмечена возможность существования ДБ только с амплитудой колебаний более 0,2 от межатомного расстояния.</p></abstract><trans-abstract xml:lang="en"><p>This paper explores the modeling of stationary and oscillating discrete breathers in a biatomic crystal of the CsCl type with interatomic interactions described by the β-FPUT potential using molecular dynamics methods. Discrete breathers (DBs) are spatially localized oscillations of particles in defect-free nonlinear chains that can exist only in discrete media and nonlinear systems. Ordered CsCl-type structures belong to crystals with a body-centered cubic (BCC) lattice, the nonlinear dynamics of which have recently attracted considerable interest and attention from researchers. The history of the discovery and evolution of research into DBs and delocalized nonlinear vibrational modes (DNVMs) is presented. Growing interest in the study of mobile DBs capable of transferring energy across the crystal lattice is demonstrated. A computational cell for a bcc crystal with a CsCl structure is depicted, where the case of a large difference in the atomic masses of the components is analyzed. The DNVM and its frequency response are shown, where a gap appears in the phonon spectrum of the crystal. The frequency response of a discrete breather with a hard type of nonlinearity is presented, numerically found in the gap of the phonon spectrum by applying the localization function to the DNVM. This function has the form of a hyperbolic cosine, which allows the discrete breather frequency to deviate from the lower boundary of the phonon spectrum with increasing amplitude. Molecular dynamics simulations in the LAMMPS package resulted in discrete breathers centered on an atom and between two adjacent heavy atoms. Their motions are shown, where the atoms of the heavy sublattice move with much larger amplitudes than the light atoms. Finally, the time dependences of a stationary discrete breather centered on an atom and of discrete breathers oscillating near this configuration are shown. The possibility of the existence of discrete breathers only with an oscillation amplitude greater than 0.2 of the interatomic distance is noted.</p></trans-abstract><kwd-group xml:lang="ru"><kwd>молекулярно-динамическое моделирование</kwd><kwd>дискретный бризер</kwd><kwd>делокализованная нелинейная колебательная мода</kwd><kwd>кристаллическая решетка</kwd><kwd>биатомный кристалл</kwd><kwd>упорядоченный сплав</kwd><kwd>структура типа CsCl</kwd><kwd>частотная характеристика</kwd><kwd>функция локализации</kwd><kwd>потенциал β-FPUT</kwd><kwd>пакет LAMMPS</kwd></kwd-group><kwd-group xml:lang="en"><kwd>molecular dynamics simulation</kwd><kwd>discrete breather</kwd><kwd>delocalized nonlinear vibrational mode</kwd><kwd>crystal lattice</kwd><kwd>biatomic crystal</kwd><kwd>ordered alloy</kwd><kwd>CsCl-type structure</kwd><kwd>frequency response</kwd><kwd>localization function</kwd><kwd>β-FPUT potential</kwd><kwd>LAMMPS package</kwd></kwd-group><funding-group><funding-statement xml:lang="ru">Исследование выполнено при финансовой поддержке Российского научного фонда, грант № 24-22-00092</funding-statement><funding-statement xml:lang="en">This work was carried out as part of a research project with Finansial support from the Russian Science Foundation, grant No. 24-22-00092</funding-statement></funding-group></article-meta></front><back><ref-list><title>References</title><ref id="cit1"><label>1</label><citation-alternatives><mixed-citation xml:lang="ru">Долгов А.С. 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