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Development of Relativistic Electronic Structure Approaches for the Calculation of Structural, Mechanical and Spectroscopic Properties of Infinite Periodic Systems

Development of Relativistic Electronic Structure Approaches for the Calculation of Structural, Mechanical and Spectroscopic Properties of Infinite Periodic Systems
开发用于计算无限周期系统的结构、力学和光谱特性的相对论电子结构方法
批准号：
545643-2020
负责人：
Desmarais, Jacques
金额：
$3.28万
依托单位：
University of Turin
依托单位国家：
加拿大
项目类别：
Postdoctoral Fellowships
财政年份：
2021
资助国家：
加拿大
项目状态：
已结题
起止时间：
2021-01-01 至 2022-12-31
来源：
https://www.nserc-crsng.gc.ca/ase-oro/Details-Detailles_eng.asp?id=721108
关键词：
DevelopmentRelativisticElectronicStructureApproaches

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英文摘要
Software and Development, Theoretical Physics and Chemistry, Condensed Matter Physics, Materials Science and Technology, Inorganic Chemistry, Organic Chemistry, Geophysics, Geochemistry, Earth Science, Environmental Sciences
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Development of Relativistic Electronic Structure Approaches for the Calculation of Structural, Mechanical and Spectroscopic Properties of Infinite Periodic Systems
Development, Implementation and Application of Coupled-Perturbed-Hartree-Fock/Kohn-Sham (CPHF/KS) Techniques for the Study of Linear and Non-linear Optical Properties of Solids and Minerals
  • 批准号：
    501266-2016
  • 项目类别：
    Vanier Canada Graduate Scholarship Tri-Council - Doctoral 3 years
  • 资助金额：
    $3.64万
  • 财政年份：
    2018
  • 负责人：
    Desmarais, Jacques
  • 依托单位：
    University of Saskatchewan
Development, Implementation and Application of Coupled-Perturbed-Hartree-Fock/Kohn-Sham (CPHF/KS) Techniques for the Study of Linear and Non-linear Optical Properties of Solids and Minerals
  • 批准号：
    501266-2016
  • 项目类别：
    Vanier Canada Graduate Scholarship Tri-Council - Doctoral 3 years
  • 资助金额：
    $3.64万
  • 财政年份：
    2017
  • 负责人：
    Desmarais, Jacques
  • 依托单位：
    University of Saskatchewan
Development, Implementation and Application of Coupled-Perturbed-Hartree-Fock/Kohn-Sham (CPHF/KS) Techniques for the Study of Linear and Non-linear Optical Properties of Solids and Minerals
  • 批准号：
    501266-2016
  • 项目类别：
    Vanier Canada Graduate Scholarship Tri-Council - Doctoral 3 years
  • 资助金额：
    $3.64万
  • 财政年份：
    2016
  • 负责人：
    Desmarais, Jacques
  • 依托单位：
    University of Saskatchewan
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