First-principles study of structural, electronic, and optical properties of GaAs (001)- (2x4) with surface defects
First-principles calculations in understanding the geometrical, electronic, and optical properties of GaAs (001)- β2(2x4) and GaAs (001)- β(2x4) with defects are performed in the framework of density functional theory (DFT) and are implemented in the Vienna ab initio simulation package (VASP). The s...
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| 格式: | text |
| 語言: | English |
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Animo Repository
2023
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| 在線閱讀: | https://animorepository.dlsu.edu.ph/etdd_physics/4 https://animorepository.dlsu.edu.ph/context/etdd_physics/article/1004/viewcontent/2023_Bacuyag_First_Principles_Study_of_Structural_Electronic_Full_text.pdf |
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| 機構: | De La Salle University |
| 語言: | English |