<?xml version="1.0" encoding="UTF-8"?>
<!DOCTYPE article PUBLIC "-//NLM//DTD JATS (Z39.96) Journal Publishing DTD v1.3 20210610//EN" "JATS-journalpublishing1-3.dtd">
<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">nuc</journal-id><journal-title-group><journal-title xml:lang="ru">Вестник НЯЦ РК</journal-title><trans-title-group xml:lang="en"><trans-title>NNC RK Bulletin</trans-title></trans-title-group></journal-title-group><issn pub-type="ppub">1729-7516</issn><issn pub-type="epub">1729-7885</issn><publisher><publisher-name>Национальный ядерный центр Республики Казахстан</publisher-name></publisher></journal-meta><article-meta><article-id pub-id-type="doi">10.52676/1729-7885-2025-4-41-46</article-id><article-id custom-type="elpub" pub-id-type="custom">nuc-890</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>Статьи</subject></subj-group></article-categories><title-group><article-title>ТЕОРЕТИЧЕСКОЕ ИССЛЕДОВАНИЕ ВЛИЯНИЯ ТЕМПЕРАТУРЫ И ДЕФЕКТОВ НА ЭЛАСТИЧНОСТЬ ДЕФОРМИРОВАННОГО ПРИ РАСТЯЖЕНИИ АЛМАЗА</article-title><trans-title-group xml:lang="en"><trans-title>THEORETICAL STUDY OF THE EFFECT OF TEMPERATURE AND DEFECTS  ON THE ELASTICITY OF A DIAMOND DEFORMED BY STRETCHING</trans-title></trans-title-group></title-group><contrib-group><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0003-2378-4082</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Инербаев</surname><given-names>Т. М.</given-names></name><name name-style="western" xml:lang="en"><surname>Inerbaev</surname><given-names>T. M.</given-names></name></name-alternatives><bio xml:lang="ru"><p>Астана</p></bio><bio xml:lang="en"><p>Astana</p></bio><xref ref-type="aff" rid="aff-1"/></contrib><contrib contrib-type="author" corresp="yes"><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Абуова</surname><given-names>А. У.</given-names></name><name name-style="western" xml:lang="en"><surname>Abuova</surname><given-names>A. U.</given-names></name></name-alternatives><bio xml:lang="ru"><p>Астана</p></bio><bio xml:lang="en"><p>Astana</p></bio><xref ref-type="aff" rid="aff-1"/></contrib><contrib contrib-type="author" corresp="yes"><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Абуова</surname><given-names>Ф. У.</given-names></name><name name-style="western" xml:lang="en"><surname>Abuova</surname><given-names>F. U.</given-names></name></name-alternatives><bio xml:lang="ru"><p>Астана</p></bio><bio xml:lang="en"><p>Astana</p></bio><email xlink:type="simple">abuova_fu@enu.kz</email><xref ref-type="aff" rid="aff-1"/></contrib><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0001-5586-7339</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Қаптағай</surname><given-names>Г. А.</given-names></name><name name-style="western" xml:lang="en"><surname>Kaptagai</surname><given-names>G. A.</given-names></name></name-alternatives><bio xml:lang="ru"><p>Астана</p></bio><bio xml:lang="en"><p>Astana</p></bio><xref ref-type="aff" rid="aff-1"/></contrib><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0002-1706-1622</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Мерәлі</surname><given-names>Н.</given-names></name><name name-style="western" xml:lang="en"><surname>Merali</surname><given-names>N.</given-names></name></name-alternatives><bio xml:lang="ru"><p>Астана</p></bio><bio xml:lang="en"><p>Astana</p></bio><xref ref-type="aff" rid="aff-1"/></contrib><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0001-9777-9943</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Зәкиева</surname><given-names>Ж. К.</given-names></name><name name-style="western" xml:lang="en"><surname>Zakieva</surname><given-names>Zh. K.</given-names></name></name-alternatives><bio xml:lang="ru"><p>Астана</p></bio><bio xml:lang="en"><p>Astana</p></bio><xref ref-type="aff" rid="aff-1"/></contrib><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0009-0009-2915-8462</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Сатанова</surname><given-names>Б. М.</given-names></name><name name-style="western" xml:lang="en"><surname>Satanova</surname><given-names>B. M.</given-names></name></name-alternatives><bio xml:lang="ru"><p>Астана</p></bio><bio xml:lang="en"><p>Astana</p></bio><email xlink:type="simple">clever_s.balzhan@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/0009-0001-6819-9058</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Раскалиев</surname><given-names>А.</given-names></name><name name-style="western" xml:lang="en"><surname>Raskaliev</surname><given-names>A.</given-names></name></name-alternatives><bio xml:lang="ru"><p>Астана</p></bio><bio xml:lang="en"><p>Astana</p></bio><xref ref-type="aff" rid="aff-1"/></contrib></contrib-group><aff-alternatives id="aff-1"><aff xml:lang="ru">Евразийский национальный университет имени Л.Н. Гумилева<country>Казахстан</country></aff><aff xml:lang="en">L.N. Gumilyov Eurasian National University<country>Kazakhstan</country></aff></aff-alternatives><pub-date pub-type="collection"><year>2025</year></pub-date><pub-date pub-type="epub"><day>08</day><month>12</month><year>2025</year></pub-date><volume>0</volume><issue>4</issue><fpage>41</fpage><lpage>46</lpage><permissions><copyright-statement>Copyright &amp;#x00A9; Инербаев Т.М., Абуова А.У., Абуова Ф.У., Қаптағай Г.А., Мерәлі Н., Зәкиева Ж.К., Сатанова Б.М., Раскалиев А., 2025</copyright-statement><copyright-year>2025</copyright-year><copyright-holder xml:lang="ru">Инербаев Т.М., Абуова А.У., Абуова Ф.У., Қаптағай Г.А., Мерәлі Н., Зәкиева Ж.К., Сатанова Б.М., Раскалиев А.</copyright-holder><copyright-holder xml:lang="en">Inerbaev T.M., Abuova A.U., Abuova F.U., Kaptagai G.A., Merali N., Zakieva Z.K., Satanova B.M., Raskaliev A.</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://journals.nnc.kz/jour/article/view/890">https://journals.nnc.kz/jour/article/view/890</self-uri><abstract><p>В данной работе в рамках классической молекулярной динамики исследована диаграмма деформирования алмаза при растяжении, ориентированном в направлении [<xref ref-type="bibr" rid="cit111">111</xref>], в области температур от 1 до 1700 К. Рассмотрены идеальная структура алмаза, а также структура, содержащая относительно высокую концентрацию дефектов. Для изучения эластичности получаемых при различной температуре при растяжении структур проведено анизотропное моделирование при атмосферном давлении и рассчитаны величины деформации и плотности структуры во времени. Показана эластичность обеих структур в широком диапазоне величин деформации, характерных для каждого значения температуры. Также показана возможность достижения алмазом пластического состояния в узкой области величины растяжения перед полным разрушением в области высоких температур. При температуре ≤ 500 K алмаз сохраняет чисто упругое поведение вплоть до разрушения. При температурах выше 700 K вблизи предела прочности наблюдаются признаки локальной пластической деформации в виде плавного изгиба кривой напряжение–деформация. При T ≥ 1600 K идеальная структура разрушается уже на этапе эквилибрирования, что является  признаком начала графитизации. Наличие точечного дефекта снижает прочность и предельные деформации, и структура разрушается при более низких напряжениях при T ≥ 1300 K.</p></abstract><trans-abstract xml:lang="en"><p>In this work, the diagram of diamond deformation under tension oriented in the direction [<xref ref-type="bibr" rid="cit111">111</xref>] in the temperature range from 1 to 1700 K is studied in the framework of classical molecular dynamics. The ideal diamond structure is considered, as well as a structure containing a relatively high concentration of defects. To study the elasticity of structures obtained at different temperatures during stretching, anisotropic modeling was performed at atmospheric pressure and the values of deformation and density of the structure over time were calculated. The elasticity of both structures is shown in a wide range of strain values characteristic of each temperature value. It is also shown that a diamond can achieve a plastic state in a narrow range of tensile strength before complete destruction at high temperatures.</p></trans-abstract><kwd-group xml:lang="ru"><kwd>алмаз</kwd><kwd>алмазные пленки</kwd><kwd>молекулярная динамика</kwd><kwd>деформация</kwd><kwd>эластичность</kwd></kwd-group><kwd-group xml:lang="en"><kwd>diamond</kwd><kwd>diamond films</kwd><kwd>molecular dynamics</kwd><kwd>deformation</kwd><kwd>elasticity</kwd></kwd-group><funding-group xml:lang="ru"><funding-statement>Работа выполнена в рамках проекта МОН РК AP23484367 «Исследование предела текучести алмаза для развития технологии производства крупных кристаллов».</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">Sundqvist, B. (2021). Carbon under pressure. Physics Reports, 909, 1-73.</mixed-citation><mixed-citation xml:lang="en">Sundqvist, B. (2021). Carbon under pressure. Physics Reports, 909, 1-73.</mixed-citation></citation-alternatives></ref><ref id="cit2"><label>2</label><citation-alternatives><mixed-citation xml:lang="ru">Field, J. E. (2012). The mechanical and strength properties of diamond. Reports on Progress in Physics, 75(12), 126505.</mixed-citation><mixed-citation xml:lang="en">Field, J. E. (2012). The mechanical and strength properties of diamond. Reports on Progress in Physics, 75(12), 126505.</mixed-citation></citation-alternatives></ref><ref id="cit3"><label>3</label><citation-alternatives><mixed-citation xml:lang="ru">Evans, T., &amp; James, P. F. (1964). A study of the transformation of diamond to graphite. Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 277(1369), 260-269.</mixed-citation><mixed-citation xml:lang="en">Evans, T., &amp; James, P. F. (1964). A study of the transformation of diamond to graphite. Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 277(1369), 260-269.</mixed-citation></citation-alternatives></ref><ref id="cit4"><label>4</label><citation-alternatives><mixed-citation xml:lang="ru">Wilks, J., &amp; Wilks, E. (1991). Properties and applications of diamond. Butterworth-Heinemann, Oxford, 1991, pp. 214–227.</mixed-citation><mixed-citation xml:lang="en">Wilks, J., &amp; Wilks, E. (1991). Properties and applications of diamond. Butterworth-Heinemann, Oxford, 1991, pp. 214–227.</mixed-citation></citation-alternatives></ref><ref id="cit5"><label>5</label><citation-alternatives><mixed-citation xml:lang="ru">Gogotsi, Y. G., Kailer, A., &amp; Nickel, K. G. (1999). Transformation of diamond to graphite. Nature, 401(6754), 663-664.</mixed-citation><mixed-citation xml:lang="en">Gogotsi, Y. G., Kailer, A., &amp; Nickel, K. G. (1999). Transformation of diamond to graphite. Nature, 401(6754), 663-664.</mixed-citation></citation-alternatives></ref><ref id="cit6"><label>6</label><citation-alternatives><mixed-citation xml:lang="ru">Weidner, D. J., Wang, Y., &amp; Vaughan, M. T. (1994). Strength of diamond. Science, 266(5184), 419-422.</mixed-citation><mixed-citation xml:lang="en">Weidner, D. J., Wang, Y., &amp; Vaughan, M. T. (1994). Strength of diamond. Science, 266(5184), 419-422.</mixed-citation></citation-alternatives></ref><ref id="cit7"><label>7</label><citation-alternatives><mixed-citation xml:lang="ru">Eremets, M. I., Trojan, I. A., Gwaze, P., Huth, J., Boehler, R., &amp; Blank, V. D. (2005). The strength of diamond. Applied Physics Letters, 87(14).</mixed-citation><mixed-citation xml:lang="en">Eremets, M. I., Trojan, I. A., Gwaze, P., Huth, J., Boehler, R., &amp; Blank, V. D. (2005). The strength of diamond. Applied Physics Letters, 87(14).</mixed-citation></citation-alternatives></ref><ref id="cit8"><label>8</label><citation-alternatives><mixed-citation xml:lang="ru">Lin, Y., Zhang, L., Mao, H. K., Chow, P., Xiao, Y., Baldini, M., Shu, J., &amp; Mao, W. L. (2011). Amorphous diamond: a high-pressure superhard carbon allotrope. Physical Review Letters, 107(17), 175504.</mixed-citation><mixed-citation xml:lang="en">Lin, Y., Zhang, L., Mao, H. K., Chow, P., Xiao, Y., Baldini, M., Shu, J., &amp; Mao, W. L. (2011). Amorphous diamond: a high-pressure superhard carbon allotrope. Physical Review Letters, 107(17), 175504.</mixed-citation></citation-alternatives></ref><ref id="cit9"><label>9</label><citation-alternatives><mixed-citation xml:lang="ru">Solopova, N. A., Dubrovinskaia, N., &amp; Dubrovinsky, L. (2013). Raman spectroscopy of glassy carbon up to 60 GPa. Applied Physics Letters, 102(12).</mixed-citation><mixed-citation xml:lang="en">Solopova, N. A., Dubrovinskaia, N., &amp; Dubrovinsky, L. (2013). Raman spectroscopy of glassy carbon up to 60 GPa. Applied Physics Letters, 102(12).</mixed-citation></citation-alternatives></ref><ref id="cit10"><label>10</label><citation-alternatives><mixed-citation xml:lang="ru">Yao, M., Fan, X., Zhang, W., Bao, Y., Liu, R., Sundqvist, B., &amp; Liu, B. (2017). Uniaxial-stress-driven transformation in cold compressed glassy carbon. Applied Physics Letters, 111(10).</mixed-citation><mixed-citation xml:lang="en">Yao, M., Fan, X., Zhang, W., Bao, Y., Liu, R., Sundqvist, B., &amp; Liu, B. (2017). Uniaxial-stress-driven transformation in cold compressed glassy carbon. Applied Physics Letters, 111(10).</mixed-citation></citation-alternatives></ref><ref id="cit11"><label>11</label><citation-alternatives><mixed-citation xml:lang="ru">Chacham, H., &amp; Kleinman, L. (2000). Instabilities in diamond under high shear stress. Physical review letters, 85(23), 4904.</mixed-citation><mixed-citation xml:lang="en">Chacham, H., &amp; Kleinman, L. (2000). Instabilities in diamond under high shear stress. Physical review letters, 85(23), 4904.</mixed-citation></citation-alternatives></ref><ref id="cit12"><label>12</label><citation-alternatives><mixed-citation xml:lang="ru">Telling, R. H., Pickard, C. J., Payne, M. C., &amp; Field, J. E. (2000). Theoretical strength and cleavage of diamond. Physical Review Letters, 84(22), 5160.</mixed-citation><mixed-citation xml:lang="en">Telling, R. H., Pickard, C. J., Payne, M. C., &amp; Field, J. E. (2000). Theoretical strength and cleavage of diamond. Physical Review Letters, 84(22), 5160.</mixed-citation></citation-alternatives></ref><ref id="cit13"><label>13</label><citation-alternatives><mixed-citation xml:lang="ru">Ruoff, A. L. (1979). On the yield strength of diamond. Journal of Applied Physics, 50(5), 3354-3356.</mixed-citation><mixed-citation xml:lang="en">Ruoff, A. L. (1979). On the yield strength of diamond. Journal of Applied Physics, 50(5), 3354-3356.</mixed-citation></citation-alternatives></ref><ref id="cit14"><label>14</label><citation-alternatives><mixed-citation xml:lang="ru">Vidable, G. G., Gonzalez, R. I., Valencia, F. J., Amigo, N., Tramontina, D., &amp; Bringa, E. M. (2022). Simulations of plasticity in diamond nanoparticles showing ultrahigh strength. Diamond and Related Materials, 126, 109109.</mixed-citation><mixed-citation xml:lang="en">Vidable, G. G., Gonzalez, R. I., Valencia, F. J., Amigo, N., Tramontina, D., &amp; Bringa, E. M. (2022). Simulations of plasticity in diamond nanoparticles showing ultrahigh strength. Diamond and Related Materials, 126, 109109.</mixed-citation></citation-alternatives></ref><ref id="cit15"><label>15</label><citation-alternatives><mixed-citation xml:lang="ru">Felix, L. C., Tromer, R. M., Woellner, C. F., Tiwary, C. S., &amp; Galvao, D. S. (2022). Mechanical response of pentadiamond: A DFT and molecular dynamics study. Physica B: Condensed Matter, 629, 413576.</mixed-citation><mixed-citation xml:lang="en">Felix, L. C., Tromer, R. M., Woellner, C. F., Tiwary, C. S., &amp; Galvao, D. S. (2022). Mechanical response of pentadiamond: A DFT and molecular dynamics study. Physica B: Condensed Matter, 629, 413576.</mixed-citation></citation-alternatives></ref><ref id="cit16"><label>16</label><citation-alternatives><mixed-citation xml:lang="ru">Zhou, J., Li, Y., Lu, C., Li, H., Zheng, W., Ma, Y., Gao, Z., Yang, J., &amp; He, Y. (2022). Molecular dynamics simulation of the tensile response and deformation mechanism of diamond/TiC combinations. Computational Materials Science, 215, 111779.</mixed-citation><mixed-citation xml:lang="en">Zhou, J., Li, Y., Lu, C., Li, H., Zheng, W., Ma, Y., Gao, Z., Yang, J., &amp; He, Y. (2022). Molecular dynamics simulation of the tensile response and deformation mechanism of diamond/TiC combinations. Computational Materials Science, 215, 111779.</mixed-citation></citation-alternatives></ref><ref id="cit17"><label>17</label><citation-alternatives><mixed-citation xml:lang="ru">Huang, C., Peng, X., Yang, B., Chen, X., Li, Q., Yin, D., &amp; Fu, T. (2018). Effects of strain rate and annealing temperature on tensile properties of nanocrystalline diamond. Carbon, 136, 320-328.</mixed-citation><mixed-citation xml:lang="en">Huang, C., Peng, X., Yang, B., Chen, X., Li, Q., Yin, D., &amp; Fu, T. (2018). Effects of strain rate and annealing temperature on tensile properties of nanocrystalline diamond. Carbon, 136, 320-328.</mixed-citation></citation-alternatives></ref><ref id="cit18"><label>18</label><citation-alternatives><mixed-citation xml:lang="ru">Thompson, A. P., Aktulga, H. M., Berger, R., Bolintineanu, D. S., Brown, W. M., Crozier, P. S., Veld, P. J., Kohlmeyer, A., Moore, S. G., Nguyen, T. D., Shan, R., Stevens, M. J., Tranchida, J., Trott, C., &amp; Plimpton, S. J. (2022). LAMMPS-a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales. Computer physics communications, 271, 108171.</mixed-citation><mixed-citation xml:lang="en">Thompson, A. P., Aktulga, H. M., Berger, R., Bolintineanu, D. S., Brown, W. M., Crozier, P. S., Veld, P. J., Kohlmeyer, A., Moore, S. G., Nguyen, T. D., Shan, R., Stevens, M. J., Tranchida, J., Trott, C., &amp; Plimpton, S. J. (2022). LAMMPS-a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales. Computer physics communications, 271, 108171.</mixed-citation></citation-alternatives></ref><ref id="cit19"><label>19</label><citation-alternatives><mixed-citation xml:lang="ru">Hirel, P. (2015). Atomsk: A tool for manipulating and converting atomic data files. Computer Physics Communications, 197, 212-219.</mixed-citation><mixed-citation xml:lang="en">Hirel, P. (2015). Atomsk: A tool for manipulating and converting atomic data files. Computer Physics Communications, 197, 212-219.</mixed-citation></citation-alternatives></ref><ref id="cit20"><label>20</label><citation-alternatives><mixed-citation xml:lang="ru">O’connor, T. C., Andzelm, J., &amp; Robbins, M. O. (2015). AIREBO-M: A reactive model for hydrocarbons at extreme pressures. The Journal of chemical physics, 142(2).</mixed-citation><mixed-citation xml:lang="en">O’connor, T. C., Andzelm, J., &amp; Robbins, M. O. (2015). AIREBO-M: A reactive model for hydrocarbons at extreme pressures. The Journal of chemical physics, 142(2).</mixed-citation></citation-alternatives></ref><ref id="cit21"><label>21</label><citation-alternatives><mixed-citation xml:lang="ru">Rozhkov, M. A., Kolesnikova, A., &amp; Romanov, A. (2024). Comparison of Interatomic Potentials for Modeling Defects in Graphene Using Molecular Dynamics. Rev. Adv. Mater. Technol., 6, 35-42.</mixed-citation><mixed-citation xml:lang="en">Rozhkov, M. A., Kolesnikova, A., &amp; Romanov, A. (2024). Comparison of Interatomic Potentials for Modeling Defects in Graphene Using Molecular Dynamics. Rev. Adv. Mater. Technol., 6, 35-42.</mixed-citation></citation-alternatives></ref><ref id="cit22"><label>22</label><citation-alternatives><mixed-citation xml:lang="ru">Shenderova, O. A., Brenner, D. W., Omeltchenko, A., Su, X., &amp; Yang, L. H. (2000). Atomistic modeling of the fracture of polycrystalline diamond. Physical Review B, 61(6), 3877.</mixed-citation><mixed-citation xml:lang="en">Shenderova, O. A., Brenner, D. W., Omeltchenko, A., Su, X., &amp; Yang, L. H. (2000). Atomistic modeling of the fracture of polycrystalline diamond. Physical Review B, 61(6), 3877.</mixed-citation></citation-alternatives></ref><ref id="cit23"><label>23</label><citation-alternatives><mixed-citation xml:lang="ru">Zhan, H., Zhang, G., Tan, V. B., Cheng, Y., Bell, J. M., Zhang, Y. W., &amp; Gu, Y. (2016). From brittle to ductile: a structure dependent ductility of diamond nanothread. Nanoscale, 8(21), 11177-11184.</mixed-citation><mixed-citation xml:lang="en">Zhan, H., Zhang, G., Tan, V. B., Cheng, Y., Bell, J. M., Zhang, Y. W., &amp; Gu, Y. (2016). From brittle to ductile: a structure dependent ductility of diamond nanothread. Nanoscale, 8(21), 11177-11184.</mixed-citation></citation-alternatives></ref><ref id="cit24"><label>24</label><citation-alternatives><mixed-citation xml:lang="ru">Baimova, J. А., Rysaeva, L. K., &amp; Rudskoy, A. I. (2018). Deformation behavior of diamond-like phases: Molecular dynamics simulation. Diamond and Related Materials, 81, 154-160.</mixed-citation><mixed-citation xml:lang="en">Baimova, J. А., Rysaeva, L. K., &amp; Rudskoy, A. I. (2018). Deformation behavior of diamond-like phases: Molecular dynamics simulation. Diamond and Related Materials, 81, 154-160.</mixed-citation></citation-alternatives></ref><ref id="cit25"><label>25</label><citation-alternatives><mixed-citation xml:lang="ru">Peng, Q., Chen, G., Huang, Z., Chen, X., Li, A., Cai, X., Zhang, Y., Chen, X. J., &amp; Hu, Z. (2024). Molecular Dynamics Insights into Mechanical Stability, Elastic Properties, and Fracture Behavior of PHOTH-Graphene. Materials, 17(19), 4740.</mixed-citation><mixed-citation xml:lang="en">Peng, Q., Chen, G., Huang, Z., Chen, X., Li, A., Cai, X., Zhang, Y., Chen, X. J., &amp; Hu, Z. (2024). Molecular Dynamics Insights into Mechanical Stability, Elastic Properties, and Fracture Behavior of PHOTH-Graphene. Materials, 17(19), 4740.</mixed-citation></citation-alternatives></ref><ref id="cit26"><label>26</label><citation-alternatives><mixed-citation xml:lang="ru">Roundy, D., &amp; Cohen, M. L. (2001). Ideal strength of diamond, Si, and Ge. Physical Review B, 64(21), 212103.</mixed-citation><mixed-citation xml:lang="en">Roundy, D., &amp; Cohen, M. L. (2001). Ideal strength of diamond, Si, and Ge. Physical Review B, 64(21), 212103.</mixed-citation></citation-alternatives></ref><ref id="cit27"><label>27</label><citation-alternatives><mixed-citation xml:lang="ru">Luo, X., Liu, Z., Xu, B., Yu, D., Tian, Y., Wang, H. T., &amp; He, J. (2010). Compressive strength of diamond from first-principles calculation. The Journal of Physical Chemistry C, 114(41), 17851-17853.</mixed-citation><mixed-citation xml:lang="en">Luo, X., Liu, Z., Xu, B., Yu, D., Tian, Y., Wang, H. T., &amp; He, J. (2010). Compressive strength of diamond from first-principles calculation. The Journal of Physical Chemistry C, 114(41), 17851-17853.</mixed-citation></citation-alternatives></ref><ref id="cit28"><label>28</label><citation-alternatives><mixed-citation xml:lang="ru">Jensen, B. D., Wise, K. E., &amp; Odegard, G. M. (2015). Simulation of the elastic and ultimate tensile properties of diamond, graphene, carbon nanotubes, and amorphous carbon using a revised ReaxFF parametrization. The Journal of Physical Chemistry A, 119(37), 9710-9721.</mixed-citation><mixed-citation xml:lang="en">Jensen, B. D., Wise, K. E., &amp; Odegard, G. M. (2015). Simulation of the elastic and ultimate tensile properties of diamond, graphene, carbon nanotubes, and amorphous carbon using a revised ReaxFF parametrization. The Journal of Physical Chemistry A, 119(37), 9710-9721.</mixed-citation></citation-alternatives></ref></ref-list><fn-group><fn fn-type="conflict"><p>The authors declare that there are no conflicts of interest present.</p></fn></fn-group></back></article>
