Modeling structural, elastic, electronic and optical properties of ternary cubic barium based fluoroperovskites MBaF3 (M = Ga and In) compounds based on DFT

A theoretical study of the structural, thermoelectric, and spin‐orbit coupling influenced optoelectronic properties of CsTmCl 3 halide perovskite

(2019) Malak Azmat Ali et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

IRelast package

(2018) M. Jamal et al.   JOURNAL OF ALLOYS AND COMPOUNDS

Ab Initio Study of the Mechanical, Thermal and Optoelectronic Properties of the Cubic CsBaF3

(2015) M. Harmel et al.   ACTA PHYSICA POLONICA A

First-principles calculations of two cubic fluoropervskite compounds: RbFeF3 and RbNiF3

(2015) A.A. Mubarak et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

Ab initio study of the structural, electronic and optical properties of the fluoropervskite SrXF3 (X=Li, Na, K and Rb) compounds

(2013) A.A. Mubarak   COMPUTATIONAL MATERIALS SCIENCE

Transition metal NaMF3 compounds as model systems for studying the feasibility of ternary Li-M-F and Na-M-F single phases as cathodes for lithium–ion and sodium–ion batteries

(2013) Nikolay Dimov et al.   ELECTROCHIMICA ACTA

Organometal Perovskite Light Absorbers Toward a 20% Efficiency Low-Cost Solid-State Mesoscopic Solar Cell

(2013) Nam-Gyu Park   Journal of Physical Chemistry Letters

First principle study of CsSrM3 (M=F, Cl)

(2013) Hayatullah et al.   PHYSICA B-CONDENSED MATTER

Irradiation effect on luminescence properties of fluoroperovskite single crystal (LiBaF3:Eu2+)

(2013) D. Joseph Daniel et al.   RADIATION PHYSICS AND CHEMISTRY

Shift of indirect to direct bandgap and optical response of LaAlO3 under pressure

(2012) G. Murtaza et al.   JOURNAL OF APPLIED PHYSICS

Kramers–Kronig, Bode, and the meaning of zero

(2011) John Bechhoefer   AMERICAN JOURNAL OF PHYSICS

Investigation of structural and optoelectronic properties of BaThO3

(2010) G. Murtaza et al.   OPTICAL MATERIALS

Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential

(2009) Fabien Tran et al.   PHYSICAL REVIEW LETTERS