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gallium-arsenide

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teocobos / gaas-defect-modelling

First-principles modelling of native defects and electronic properties in GaAs.

dft first-principles vasp density-functional-theory cp2k electronic-structure semiconductors gaas materials-modelling point-defects computational-materials-science defect-physics charged-defects iii-v-semiconductors gallium-arsenide

Updated Aug 31, 2026
Python

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