Mahtab Jamshidipour , Mona Abdi , Bandar Astinchap
{"title":"化学势、应变和自旋轨道耦合影响下的线心蜂窝结构的热电性能","authors":"Mahtab Jamshidipour , Mona Abdi , Bandar Astinchap","doi":"10.1016/j.jpcs.2025.112795","DOIUrl":null,"url":null,"abstract":"<div><div>This paper investigates the thermoelectric properties of the line-centered honeycomb (LCH) structure, focusing on four key transport coefficients: electrical conductivity, thermal conductivity, Seebeck coefficient, and figure of merit. The results reveal that thermal conductivity increases with chemical potential until peaking, whereas electrical conductivity reaches its maximum at zero chemical potential and decreases with further changes in chemical potential. The influence of spin-orbit coupling (SOC), tensile and compressive strain, and a transverse magnetic field on the thermoelectric properties is also thoroughly examined, yielding notable findings. The two key factors influencing conductivity are SOC and strain in the form of compression. The application of these parameters enhances both electrical and thermal conductivity. Additionally, density of states (DOS) diagrams under specific conditions are analyzed to provide deeper insights into the electronic behavior of the LCH structure. The study uses the tight-binding method and Green's function framework, offering a robust approach to understanding the material's thermoelectric response.</div></div>","PeriodicalId":16811,"journal":{"name":"Journal of Physics and Chemistry of Solids","volume":"205 ","pages":"Article 112795"},"PeriodicalIF":4.3000,"publicationDate":"2025-04-19","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Thermoelectric performance of line-centered honeycomb structures under the influence of chemical potential, strain, and spin-orbit coupling\",\"authors\":\"Mahtab Jamshidipour , Mona Abdi , Bandar Astinchap\",\"doi\":\"10.1016/j.jpcs.2025.112795\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>This paper investigates the thermoelectric properties of the line-centered honeycomb (LCH) structure, focusing on four key transport coefficients: electrical conductivity, thermal conductivity, Seebeck coefficient, and figure of merit. The results reveal that thermal conductivity increases with chemical potential until peaking, whereas electrical conductivity reaches its maximum at zero chemical potential and decreases with further changes in chemical potential. The influence of spin-orbit coupling (SOC), tensile and compressive strain, and a transverse magnetic field on the thermoelectric properties is also thoroughly examined, yielding notable findings. The two key factors influencing conductivity are SOC and strain in the form of compression. The application of these parameters enhances both electrical and thermal conductivity. Additionally, density of states (DOS) diagrams under specific conditions are analyzed to provide deeper insights into the electronic behavior of the LCH structure. The study uses the tight-binding method and Green's function framework, offering a robust approach to understanding the material's thermoelectric response.</div></div>\",\"PeriodicalId\":16811,\"journal\":{\"name\":\"Journal of Physics and Chemistry of Solids\",\"volume\":\"205 \",\"pages\":\"Article 112795\"},\"PeriodicalIF\":4.3000,\"publicationDate\":\"2025-04-19\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Physics and Chemistry of Solids\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0022369725002471\",\"RegionNum\":3,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Physics and Chemistry of Solids","FirstCategoryId":"88","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0022369725002471","RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
Thermoelectric performance of line-centered honeycomb structures under the influence of chemical potential, strain, and spin-orbit coupling
This paper investigates the thermoelectric properties of the line-centered honeycomb (LCH) structure, focusing on four key transport coefficients: electrical conductivity, thermal conductivity, Seebeck coefficient, and figure of merit. The results reveal that thermal conductivity increases with chemical potential until peaking, whereas electrical conductivity reaches its maximum at zero chemical potential and decreases with further changes in chemical potential. The influence of spin-orbit coupling (SOC), tensile and compressive strain, and a transverse magnetic field on the thermoelectric properties is also thoroughly examined, yielding notable findings. The two key factors influencing conductivity are SOC and strain in the form of compression. The application of these parameters enhances both electrical and thermal conductivity. Additionally, density of states (DOS) diagrams under specific conditions are analyzed to provide deeper insights into the electronic behavior of the LCH structure. The study uses the tight-binding method and Green's function framework, offering a robust approach to understanding the material's thermoelectric response.
期刊介绍:
The Journal of Physics and Chemistry of Solids is a well-established international medium for publication of archival research in condensed matter and materials sciences. Areas of interest broadly include experimental and theoretical research on electronic, magnetic, spectroscopic and structural properties as well as the statistical mechanics and thermodynamics of materials. The focus is on gaining physical and chemical insight into the properties and potential applications of condensed matter systems.
Within the broad scope of the journal, beyond regular contributions, the editors have identified submissions in the following areas of physics and chemistry of solids to be of special current interest to the journal:
Low-dimensional systems
Exotic states of quantum electron matter including topological phases
Energy conversion and storage
Interfaces, nanoparticles and catalysts.