Electronic, optical and thermoelectric properties of two-dimensional pentagonal SiGeC4 nanosheet for photovoltaic applications: First-principles calculations

First-principles study on the structural, electronic and optical properties of vacancy-ordered double perovskites Cs2PtI6 and Rb2PtI6

(2021) Xian-Hao Zhao et al.   OPTICAL MATERIALS

Computational identification of efficient 2D Aluminium chalcogenides monolayers for optoelectronics and photocatalysts applications

(2021) Zakaryae Haman et al.   APPLIED SURFACE SCIENCE

Simulation and optimization studies on CsPbI3 based inorganic perovskite solar cells

(2021) Deepthi Jayan K et al.   SOLAR ENERGY

Two-dimensional Janus Sn2SSe and SnGeS2 semiconductors as strong absorber candidates for photovoltaic solar cells: First principles computations

(2021) I. Bouziani et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES

Ab initio study of electronic and optical properties of penta-SiC2 and -SiGeC4 monolayers for solar energy conversion

(2020) I. Bouziani et al.   SUPERLATTICES AND MICROSTRUCTURES

Electronic and optical properties of PdSe2 from monolayer to trilayer

(2020) Xu Zhao et al.   SUPERLATTICES AND MICROSTRUCTURES

Cs2InGaX6 (X=Cl, Br, or I): Emergent Inorganic Halide Double Perovskites with enhanced optoelectronic characteristics

(2020) M. Kibbou et al.   CURRENT APPLIED PHYSICS

First-Principles Study of the Hexagonal T-Phase PdSe2 Monolayer and Its Application in Solar Cells

(2020) Mukesh Jakhar et al.   Journal of Physical Chemistry C

Structural, electronic and optical properties of two-dimensional Janus transition metal oxides MXO (M=Ti, Hf and Zr; X=S and Se) for photovoltaic and opto-electronic applications

(2020) Z. Haman et al.   PHYSICA B-CONDENSED MATTER

Half-metallic ferromagnetic behavior in (Ga, Cr)N and (Ga, Cr, V)N compounds for spintronic technologies: Ab-initio and Monte Carlo methods

(2019) I. Bouziani et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

Comment on ‘The Computational 2D Materials Database: high-throughput modeling and discovery of atomically thin crystals’

(2019) Marcin Maździarz   2D Materials

Electronic- and optical-properties of ZnO nano-sheet doped and codoped with Be and/or Mg for ultraviolet opto-electronic technologies: density functional calculations

(2019) Ilyas Bouziani et al.   PHYSICA SCRIPTA

The electronic, magnetic and electrical properties of Mn2FeReO6: Ab-initio calculations and Monte-Carlo simulation

(2019) M. Kibbou et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

High Curie temperature in halfmetallic ferromagnets (Zn, Cr, Ti)Se and (Zn, Cr, Ti)Te for spintronic devices: Ab initio and Monte Carlo treatments

(2019) I. Bouziani et al.   Materials Science and Engineering B-Advanced Functional Solid-State Materials

BoltzTraP2 , a program for interpolating band structures and calculating semi-classical transport coefficients

(2018) Georg K.H. Madsen et al.   COMPUTER PHYSICS COMMUNICATIONS

Magnetoelectronic properties of Vanadium impurities co-doped (Cd, Cr)Te compound for spintronic devices: First principles calculations and Monte Carlo simulation

(2018) I. Bouziani et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

Insight into lead-free organic-inorganic hybrid perovskites for photovoltaics and optoelectronics: A first-principles study

(2018) Md Roknuzzaman et al.   ORGANIC ELECTRONICS

Strain tuned InSe/MoS2 bilayer van der Waals heterostructures for photovoltaics or photocatalysis

(2018) J. Zhang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Electronic and optical properties of ultra-thin 2D tungsten disulfide for photovoltaic applications

(2018) Sayan Roy et al.   SOLAR ENERGY MATERIALS AND SOLAR CELLS

Two-dimensional GeSe for high performance thin-film solar cells

(2018) Xingshuai Lv et al.   Journal of Materials Chemistry A

High-Throughput Computational Screening of Vertical 2D van der Waals Heterostructures for High-efficiency Excitonic Solar Cells

(2018) Jiajun Linghu et al.   ACS Applied Materials & Interfaces

Magnetoelectronic properties of GaN codoped with (V, Mn) impurities for spintronic devices: Ab-initio and Monte Carlo studies

(2018) I. Bouziani et al.   PHYSICA A-STATISTICAL MECHANICS AND ITS APPLICATIONS

KAgSe: A New Two-Dimensional Efficient Photovoltaic Material with Layer-Independent Behaviors

(2018) Qiang Wang et al.   ACS Applied Materials & Interfaces

Tunable optical and electronic properties of gallium telluride monolayer for photovoltaic absorbers and ultraviolet detectors

(2018) Shurooq Sabah Abed Al- Abbas et al.   CHEMICAL PHYSICS LETTERS

Physical Properties and Photovoltaic Application of Semiconducting Pd2Se3 Monolayer

(2018) Xiaoyin Li et al.   Nanomaterials

Unveiling the Crystal Formation of Cesium Lead Mixed-Halide Perovskites for Efficient and Stable Solar Cells

(2017) Jae Keun Nam et al.   Journal of Physical Chemistry Letters

Optimization of the Ag/PCBM interface by a rhodamine interlayer to enhance the efficiency and stability of perovskite solar cells

(2017) John Ciro et al.   Nanoscale

Organic-Inorganic Hybrid Perovskite with Controlled Dopant Modification and Application in Photovoltaic Device

(2017) Wangen Zhao et al.   Small

Improving the efficiency and stability of inverted perovskite solar cells with dopamine-copolymerized PEDOT:PSS as a hole extraction layer

(2017) Ju Huang et al.   Journal of Materials Chemistry A

Design of new photovoltaic systems based on two-dimensional group-IV monochalcogenides for high performance solar cells

(2017) Pei Zhao et al.   Journal of Materials Chemistry A

Tuning electronic structure and optical properties of ZnO monolayer by Cd doping

(2016) Changlong Tan et al.   CERAMICS INTERNATIONAL

Experimental study of phase change materials for photovoltaic modules: Energy performance and economic yield for the EPEX spot market

(2016) Ewald Japs et al.   SOLAR ENERGY

Penta-graphene: A new carbon allotrope

(2015) Shunhong Zhang et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Connecting Thermoelectric Performance and Topological-Insulator Behavior:Bi2Te3andBi2Te2Sefrom First Principles

(2015) Hongliang Shi et al.   Physical Review Applied

First-principles calculations for point defects in solids

(2014) Christoph Freysoldt et al.   REVIEWS OF MODERN PHYSICS

Band nesting and the optical response of two-dimensional semiconducting transition metal dichalcogenides

(2013) A. Carvalho et al.   PHYSICAL REVIEW B

Solar Thermoelectric Generator for Micropower Applications

(2010) R. Amatya et al.   JOURNAL OF ELECTRONIC MATERIALS

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

(2009) Fabien Tran et al.   PHYSICAL REVIEW LETTERS

First-principles calculations of the ferroelastic transition between rutile-type andCaCl2-typeSiO2at high pressures

(2008) Atsushi Togo et al.   PHYSICAL REVIEW B

Enhancement of Thermoelectric Efficiency in PbTe by Distortion of the Electronic Density of States

(2008) J. P. Heremans et al.   SCIENCE