DiracBilinears.jl: A package for computing Dirac bilinears in solids
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arXiv
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| Hauptverfasser: | , , , |
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| Format: | Preprint |
| Veröffentlicht: |
2025
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| _version_ | 1866914074007175168 |
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| author | Miki, Tatsuya Chen, Hsiao-Yi Koretsune, Takashi Nomura, Yusuke |
| author_facet | Miki, Tatsuya Chen, Hsiao-Yi Koretsune, Takashi Nomura, Yusuke |
| contents | DiracBilinears.jl is a Julia package for computing Dirac bilinears, which are fundamental physical quantities of electrons in relativistic quantum theory, using first-principles calculations for solids. In relativistic quantum theory, 16 independent bilinears can be defined using the four-component Dirac field. We take the non-relativistic limit for the bilinears, which corresponds to the $1/m$ expansion, and focus on the low-energy physics typically considered in condensed matter physics. This package can evaluate the spatial distributions and Wannier matrix elements of the Dirac bilinears in solids quantitatively by connecting to the external first-principles calculation packages, including Quantum ESPRESSO, Wannier90, and wan2respack. |
| format | Preprint |
| id |
arxiv_https___arxiv_org_abs_2503_11039 |
| institution | arXiv |
| publishDate | 2025 |
| record_format | arxiv |
| spellingShingle | DiracBilinears.jl: A package for computing Dirac bilinears in solids Miki, Tatsuya Chen, Hsiao-Yi Koretsune, Takashi Nomura, Yusuke Materials Science Mesoscale and Nanoscale Physics Computational Physics DiracBilinears.jl is a Julia package for computing Dirac bilinears, which are fundamental physical quantities of electrons in relativistic quantum theory, using first-principles calculations for solids. In relativistic quantum theory, 16 independent bilinears can be defined using the four-component Dirac field. We take the non-relativistic limit for the bilinears, which corresponds to the $1/m$ expansion, and focus on the low-energy physics typically considered in condensed matter physics. This package can evaluate the spatial distributions and Wannier matrix elements of the Dirac bilinears in solids quantitatively by connecting to the external first-principles calculation packages, including Quantum ESPRESSO, Wannier90, and wan2respack. |
| title | DiracBilinears.jl: A package for computing Dirac bilinears in solids |
| topic | Materials Science Mesoscale and Nanoscale Physics Computational Physics |
| url | https://arxiv.org/abs/2503.11039 |