Ab-initio calculations of electronic, transport, and structural properties of boron phosphide

Density functional theory description of electronic properties of wurtzite zinc oxide

(2013) L. Franklin et al.   JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS

Band gap calculations of the semiconductor BNxP1−x using modified Becke–Johnson approximation

(2012) M. Benkraouda et al.   JOURNAL OF ALLOYS AND COMPOUNDS

Electronic, structural, and elastic properties of metal nitrides XN (X = Sc, Y): A first principle study

(2012) Chinedu E. Ekuma et al.   AIP Advances

Electronic structure of (BP)n/(BAs)n (001) superlattices

(2011) M. Merabet et al.   PHYSICA B-CONDENSED MATTER

Structural and electronic properties of zinc blende BxAl1−xNyP1−y quaternary alloys via first-principle calculations

(2011) A. Abdiche et al.   PHYSICA B-CONDENSED MATTER

Simulation of optical function for phosphide crystals following the DFT band structure calculations

(2011) Z.-Y. Jiao et al.   Computational and Theoretical Chemistry

Contraction of gaussian basis sets and the total energy of fcc copper

(2010) D. Bagayoko   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

First-principles study on structural properties and phase stability of III-phosphide (BP, GaP, AlP and InP)

(2009) O. Arbouche et al.   COMPUTATIONAL MATERIALS SCIENCE

The structural and electronic properties of BAs and BP compounds and BPxAs1−x alloys

(2009) Rezek Mohammad et al.   JOURNAL OF ALLOYS AND COMPOUNDS

First-principles study of zinc-blende to rocksalt phase transition in BP and BAs

(2008) Shouxin Cui et al.   COMPUTATIONAL MATERIALS SCIENCE

Comment on “Band gap bowing and electron localization of GaXIn1−XN” [J. Appl. Phys. 100, 093717 (2006)]

(2008) D. Bagayoko et al.   JOURNAL OF APPLIED PHYSICS

First-principles study of the structural and electronic properties of III-phosphides

(2007) Rashid Ahmed et al.   PHYSICA B-CONDENSED MATTER

Boron phosphide films prepared by co-evaporation technique: Synthesis and characterization

(2007) S. Dalui et al.   THIN SOLID FILMS