First principles calculations of Al AsxP1-x ternary nanocrystal alloying composition

First principles calculations of Al AsxP1-x ternary nanocrystal alloying composition

III-V zinc-blende AlP, AlAs semiconductors and their alloy Aluminum Arsenide phosphide Al AsxP1-x ternary nanocrystals have been investigated using Ab- initio density functional theory (Ab-initio-DFT) at the generalized-gradient approximation (GGA) level with STO-3G basis set coupled with large uni...

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Bibliographic Details
Main Author:	Mohammed T. Hussein
Format:	Article
Language:	English
Published:	University of Baghdad 2019-01-01
Series:	Iraqi Journal of Physics
Subjects:	Ab-initio, DFT, Al AsxP1-x alloying composition.
Online Access:	https://ijp.uobaghdad.edu.iq/index.php/physics/article/view/140

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