<?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="en"><front><journal-meta><journal-id journal-id-type="publisher-id">najo</journal-id><journal-title-group><journal-title xml:lang="en">Nanosystems: Physics, Chemistry, Mathematics</journal-title><trans-title-group xml:lang="ru"><trans-title>Наносистемы: физика, химия, математика</trans-title></trans-title-group></journal-title-group><issn pub-type="ppub">2220-8054</issn><issn pub-type="epub">2305-7971</issn><publisher><publisher-name>Университет ИТМО</publisher-name></publisher></journal-meta><article-meta><article-id pub-id-type="doi">10.17586/2220-8054-2024-15-2-255-259</article-id><article-id custom-type="elpub" pub-id-type="custom">najo-59</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="en"><subject>CHEMISTRY AND MATERIALS SCIENCE</subject></subj-group><subj-group subj-group-type="section-heading" xml:lang="ru"><subject>ХИМИЯ И НАУКА О МАТЕРИАЛАХ</subject></subj-group></article-categories><title-group><article-title>Numerical model of temperature-dependent thermal conductivity in M1−x Rx F2+x  heterovalent solid solution nanocomposites where M stands for alkaline-earth metals and R for rare-earth metals</article-title><trans-title-group xml:lang="ru"><trans-title>Расчетная модель температурной зависимости теплопроводности нанокомпозитов - гетеровалентных твердых растворов M1-xRxF2+x, где М – щелочноземельные, R -редкоземельные элементы</trans-title></trans-title-group></title-group><contrib-group><contrib contrib-type="author" corresp="yes"><contrib-id contrib-id-type="orcid">https://orcid.org/0000-0001-7555-1390</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Попов</surname><given-names>П. А.</given-names></name><name name-style="western" xml:lang="en"><surname>Popov</surname><given-names>P. A.</given-names></name></name-alternatives><bio xml:lang="ru"><p>241036 Брянск, ул. Бежицкая, 14</p></bio><bio xml:lang="en"><p>Pavel A. Popov.</p><p>14 Bezhitskaya str., Bryansk, 241036</p></bio><email xlink:type="simple">tfbgubry@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/0009-0001-4090-2506</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Щелоков</surname><given-names>А. В.</given-names></name><name name-style="western" xml:lang="en"><surname>Shchelokov</surname><given-names>A. V.</given-names></name></name-alternatives><bio xml:lang="ru"><p>241036 Брянск, ул. Бежицкая, 14</p></bio><bio xml:lang="en"><p>Alexander V. Shchelokov.</p><p>14 Bezhitskaya str., Bryansk, 241036</p></bio><email xlink:type="simple">alexandershchelokov@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/0000-0002-2918-3926</contrib-id><name-alternatives><name name-style="eastern" xml:lang="ru"><surname>Федоров</surname><given-names>П. П.</given-names></name><name name-style="western" xml:lang="en"><surname>Fedorov</surname><given-names>P. P.</given-names></name></name-alternatives><bio xml:lang="ru"><p>119991 Москва, ул. Вавилова, 38</p></bio><bio xml:lang="en"><p>Pavel P. Fedorov.</p><p>38 Vavilova str., Moscow, 119991</p></bio><email xlink:type="simple">ppfedorov@yandex.ru</email><xref ref-type="aff" rid="aff-2"/></contrib></contrib-group><aff-alternatives id="aff-1"><aff xml:lang="ru">Брянский государственный университет им. И.Г. Петровского<country>Россия</country></aff><aff xml:lang="en">Petrovsky Bryansk State University<country>Russian Federation</country></aff></aff-alternatives><aff-alternatives id="aff-2"><aff xml:lang="ru">Институт общей физики им. А.М. Прохорова Российской академии наук<country>Россия</country></aff><aff xml:lang="en">Prokhorov General Physics Institute of the Russian Academy of Sciences<country>Russian Federation</country></aff></aff-alternatives><pub-date pub-type="collection"><year>2024</year></pub-date><pub-date pub-type="epub"><day>31</day><month>05</month><year>2025</year></pub-date><volume>15</volume><issue>2</issue><fpage>255</fpage><lpage>259</lpage><permissions><copyright-statement>Copyright &amp;#x00A9; Popov P.A., Shchelokov A.V., Fedorov P.P., 2025</copyright-statement><copyright-year>2025</copyright-year><copyright-holder xml:lang="ru">Попов П.А., Щелоков А.В., Федоров П.П.</copyright-holder><copyright-holder xml:lang="en">Popov P.A., Shchelokov A.V., Fedorov P.P.</copyright-holder><license 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://nanojournal.ifmo.ru/jour/article/view/59">https://nanojournal.ifmo.ru/jour/article/view/59</self-uri><abstract><p>We propose a mathematical model to fit the temperature-dependent thermal conductivity of M1−xRxF2+x heterovalent solid solutions where M stands for alkaline-earth metals and R for rare-earth metals. These solid solutions experience composition-driven transition from the crystal-like to glass-like behavior of thermal conductivity. When tested on Ca1−xYbxF2+x solid solutions, the model showed a potential for use with an option for further improvements.</p></abstract><trans-abstract xml:lang="ru"><p>Предлагается математическое выражение для описания температурной зависимости теплопроводности гетеровалентных твердых растворов M1-xRxF2+x, где М – щелочноземельные, R -редкоземельные элементы в, демонстрирующих концентрационный переход теплопроводности от кристаллической к стеклоподобной. Апробация на примере твердого раствора Са1-xYbxF2+х показывает перспективность предлагаемой модели с возможностью улучшающих модификаций.</p></trans-abstract><kwd-group xml:lang="ru"><kwd>теплопроводность</kwd><kwd>тепловое сопротивление</kwd><kwd>температурная зависимость</kwd><kwd>твердый раствор</kwd><kwd>математическая модель</kwd></kwd-group><kwd-group xml:lang="en"><kwd>thermal conductivity</kwd><kwd>thermal resistance</kwd><kwd>temperature dependence</kwd><kwd>solid solution</kwd><kwd>mathematical model</kwd></kwd-group></article-meta></front><back><ref-list><title>References</title><ref id="cit1"><label>1</label><citation-alternatives><mixed-citation xml:lang="ru">Peierls R. Zur kinetischen theorie der warmeleitung in kristallen. Annalen der Physik, 1929, 3, P. 1055–1101.</mixed-citation><mixed-citation xml:lang="en">Peierls R. Zur kinetischen theorie der warmeleitung in kristallen. Annalen der Physik, 1929, 3, P. 1055–1101.</mixed-citation></citation-alternatives></ref><ref id="cit2"><label>2</label><citation-alternatives><mixed-citation xml:lang="ru">Klemens P.G. Thermal conductivity and lattice vibrational modes. Solid State Phys., 1958, 7, P. 1–98.</mixed-citation><mixed-citation xml:lang="en">Klemens P.G. Thermal conductivity and lattice vibrational modes. Solid State Phys., 1958, 7, P. 1–98.</mixed-citation></citation-alternatives></ref><ref id="cit3"><label>3</label><citation-alternatives><mixed-citation xml:lang="ru">Callaway J. Model for lattice thermal conductivity at low temperatures. Phys. Rev., 1959, 113 (4), P. 1046–1051.</mixed-citation><mixed-citation xml:lang="en">Callaway J. Model for lattice thermal conductivity at low temperatures. Phys. Rev., 1959, 113 (4), P. 1046–1051.</mixed-citation></citation-alternatives></ref><ref id="cit4"><label>4</label><citation-alternatives><mixed-citation xml:lang="ru">Callaway J., Baeyer H.C. Effect of point imperfections on lattice thermal conductivity. Phys. Rev., 1960, 120 (4), P. 1149–1154.</mixed-citation><mixed-citation xml:lang="en">Callaway J., Baeyer H.C. Effect of point imperfections on lattice thermal conductivity. Phys. Rev., 1960, 120 (4), P. 1149–1154.</mixed-citation></citation-alternatives></ref><ref id="cit5"><label>5</label><citation-alternatives><mixed-citation xml:lang="ru">Berman R. Thermal Conduction in Solids. Clarendon Press, Oxford, 1976.</mixed-citation><mixed-citation xml:lang="en">Berman R. Thermal Conduction in Solids. Clarendon Press, Oxford, 1976.</mixed-citation></citation-alternatives></ref><ref id="cit6"><label>6</label><citation-alternatives><mixed-citation xml:lang="ru">Gaumé R., Viana B., Vivien D., Roger J.-P., Fournier D. A simple model for the prediction of thermal conductivity in pure and doped insulating crystals. Appl. Phys. Lett., 2003, 83 (7), P. 1355–1358.</mixed-citation><mixed-citation xml:lang="en">Gaumé R., Viana B., Vivien D., Roger J.-P., Fournier D. A simple model for the prediction of thermal conductivity in pure and doped insulating crystals. Appl. Phys. Lett., 2003, 83 (7), P. 1355–1358.</mixed-citation></citation-alternatives></ref><ref id="cit7"><label>7</label><citation-alternatives><mixed-citation xml:lang="ru">Kuznetcov S.V., Osiko V.V., Tkatchenko E.A., Fedorov P.P. Inorganic nanofluorides and related nanocomposites. Russ. Chem. Rev., 2006, 75 (12), P. 1065–1082.</mixed-citation><mixed-citation xml:lang="en">Kuznetcov S.V., Osiko V.V., Tkatchenko E.A., Fedorov P.P. Inorganic nanofluorides and related nanocomposites. Russ. Chem. Rev., 2006, 75 (12), P. 1065–1082.</mixed-citation></citation-alternatives></ref><ref id="cit8"><label>8</label><citation-alternatives><mixed-citation xml:lang="ru">Popov P.A., Fedorov P.P., Kuznetsov S.V., Konyushkin V.A., Osiko V.V., Basiev T.T. Thermal conductivity of single crystals of Ca1−xYbxF2+x solid solutions. Doklady Physics, 2008, 53 (4), P. 198–200.</mixed-citation><mixed-citation xml:lang="en">Popov P.A., Fedorov P.P., Kuznetsov S.V., Konyushkin V.A., Osiko V.V., Basiev T.T. Thermal conductivity of single crystals of Ca1−xYbxF2+x solid solutions. Doklady Physics, 2008, 53 (4), P. 198–200.</mixed-citation></citation-alternatives></ref><ref id="cit9"><label>9</label><citation-alternatives><mixed-citation xml:lang="ru">Popov P.A., Fedorov P.P., Kuznetsov S.V., Konyushkin V.A., Osiko V.V., Basiev T.T. Thermal conductivity of single crystals of Ba1−xYbxF2+x. Doklady Physics, 2008, 53 (7), P. 353–355.</mixed-citation><mixed-citation xml:lang="en">Popov P.A., Fedorov P.P., Kuznetsov S.V., Konyushkin V.A., Osiko V.V., Basiev T.T. Thermal conductivity of single crystals of Ba1−xYbxF2+x. Doklady Physics, 2008, 53 (7), P. 353–355.</mixed-citation></citation-alternatives></ref><ref id="cit10"><label>10</label><citation-alternatives><mixed-citation xml:lang="ru">Popov P.A., Fedorov P.P., Reiterov V.M., Garibin E.A., Demidenko A.A., Mironov I.A., Osiko V.V. Thermal conductivity of single crystals of Ca1−xErxF2+x and Ca1−xTmxF2+x solid solutions. Doklady Physics, 2012, 57 (3), P. 97–99.</mixed-citation><mixed-citation xml:lang="en">Popov P.A., Fedorov P.P., Reiterov V.M., Garibin E.A., Demidenko A.A., Mironov I.A., Osiko V.V. Thermal conductivity of single crystals of Ca1−xErxF2+x and Ca1−xTmxF2+x solid solutions. Doklady Physics, 2012, 57 (3), P. 97–99.</mixed-citation></citation-alternatives></ref><ref id="cit11"><label>11</label><citation-alternatives><mixed-citation xml:lang="ru">Popov P.A., Fedorov P.P., Konushkin V.A. Heat Conductivity of Ca1−xRxF2+x (R= La, Ce, or Pr; 0 ≤ x ≤ 0.25) Heterovalent Solid Solutions. Crystallogr. Rep., 2015, 60 (5), P. 744–748.</mixed-citation><mixed-citation xml:lang="en">Popov P.A., Fedorov P.P., Konushkin V.A. Heat Conductivity of Ca1−xRxF2+x (R= La, Ce, or Pr; 0 ≤ x ≤ 0.25) Heterovalent Solid Solutions. Crystallogr. Rep., 2015, 60 (5), P. 744–748.</mixed-citation></citation-alternatives></ref><ref id="cit12"><label>12</label><citation-alternatives><mixed-citation xml:lang="ru">Popov P.A., Fedorov P.P. Thermal conductivity of fluoride optical materials. Bryansk: “Desyatochka” Group of Companies, 2012. (in Russian)</mixed-citation><mixed-citation xml:lang="en">Popov P.A., Fedorov P.P. Thermal conductivity of fluoride optical materials. Bryansk: “Desyatochka” Group of Companies, 2012. (in Russian)</mixed-citation></citation-alternatives></ref><ref id="cit13"><label>13</label><citation-alternatives><mixed-citation xml:lang="ru">Liu K., Bian G., Zhang Z., Ma F., Su L. Modelling and analyzing the glass-like heat transfer behavior of rare-earth doped alkaline earth fluoride crystals. CrystEngComm, 2022, 24, 6468.</mixed-citation><mixed-citation xml:lang="en">Liu K., Bian G., Zhang Z., Ma F., Su L. Modelling and analyzing the glass-like heat transfer behavior of rare-earth doped alkaline earth fluoride crystals. CrystEngComm, 2022, 24, 6468.</mixed-citation></citation-alternatives></ref><ref id="cit14"><label>14</label><citation-alternatives><mixed-citation xml:lang="ru">Liu K., Bian G., Zhang Z., Ma F., Su L. Simulation and demonstration of glass-like heat transfer equations in rare-earth doped alkaline earth fluoride crystals. Chinese J. of Physics, 2024, 88, P. 584–593.</mixed-citation><mixed-citation xml:lang="en">Liu K., Bian G., Zhang Z., Ma F., Su L. Simulation and demonstration of glass-like heat transfer equations in rare-earth doped alkaline earth fluoride crystals. Chinese J. of Physics, 2024, 88, P. 584–593.</mixed-citation></citation-alternatives></ref><ref id="cit15"><label>15</label><citation-alternatives><mixed-citation xml:lang="ru">Matthiessen A., Vogt C. On the Influence of Temperature on the Electric Conducting-Power of Alloys. Philosophical Transactions of the Royal Society of London, 1864, 154, P. 167–200.</mixed-citation><mixed-citation xml:lang="en">Matthiessen A., Vogt C. On the Influence of Temperature on the Electric Conducting-Power of Alloys. Philosophical Transactions of the Royal Society of London, 1864, 154, P. 167–200.</mixed-citation></citation-alternatives></ref><ref id="cit16"><label>16</label><citation-alternatives><mixed-citation xml:lang="ru">Lifshits I.M. Electron Theory of Metals. Springer, 1973.</mixed-citation><mixed-citation xml:lang="en">Lifshits I.M. Electron Theory of Metals. Springer, 1973.</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>
