HSE06-calculated band structure of AlAs, total density of states (DOS)
Por um escritor misterioso
Last updated 15 abril 2025


Nanomaterials, Free Full-Text

Tunable electronic and optical properties of a type-II AlAs/GaS heterojunction: first-principles calculations - CrystEngComm (RSC Publishing) DOI:10.1039/D3CE00255A
An Empirical, yet Practical Way To Predict the Band Gap in Solids by Using Density Functional Band Structure Calculations

Structural, mechanical, and electronic properties of 25 kinds of III–V binary monolayers: A computational study with first-principles calculation

Tunable electronic properties of AlAs/InP heterostructure via external electric field and uniaxial strain

An Empirical, yet Practical Way To Predict the Band Gap in Solids by Using Density Functional Band Structure Calculations

Understanding band gaps of solids in generalized Kohn–Sham theory
HSE06 surface band structures of Si(001)-2 × 1 (a) and Ge(001)-2 × 1

Efficient Band Structure Calculation of Two-Dimensional Materials from Semilocal Density Functionals
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