Electronic Structure Calculations.
Overview
| Works: | 9 works in 7 publications in 7 languages | |
|---|---|---|
Titles
First-principles and machine learning study of anharmonic vibration and dielectric properties of materials
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Ab initio molecular dynamics analysis based on reduced-dimensionality reaction route map
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Electronic band structure engineering and ultrafast dynamics of dirac semimetals
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A tutorial on the WKB approximation for innovative Dirac materials = graphene and beyond /
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Electronic structure of rare-earth nickelates from first-principles
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Subjects