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First-principles study of closo-dodecaborates M2B12H12 (M = Li, Na, K) as solid-state electrolyte materials

Physical chemistry chemical physics : PCCP, 2021-12, Vol.23 (47), p.27014-27023

2021

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Prediction of magnetoelectric properties of defect BiFeO3 thin films using Monte Carlo simulations

Journal of magnetism and magnetic materials, 2021-12, Vol.539, p.168402, Article 168402

2021

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First-principles prediction of the magnetism of 4f rare-earth-metal-doped wurtzite zinc oxide

Journal of rare earths, 2014-08, Vol.32 (8), p.715-721

2014

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An easy route to synthesize high-quality black phosphorus from amorphous red phosphorus

Materials letters, 2019-02, Vol.236, p.56-59

2019

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Chemical synthesis and magnetic properties of monodisperse cobalt ferrite nanoparticles

Journal of materials science. Materials in electronics, 2019-08, Vol.30 (16), p.14913-14922

2019

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Effect of metal and non metal doping of TiO2 on photocatalytic activities: ab initio calculations

Optical and quantum electronics, 2021-02, Vol.53 (2), Article 86

2021

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Theoretical investigation of FAPbSnGeX3 efficiency

RSC advances, 2022-03, Vol.12 (15), p.8945-8952

2022

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Tunable maximum energy product in CoFe2O4 nanopowder for permanent magnet application

Journal of magnetism and magnetic materials, 2018-12, Vol.467, p.129-134

2018

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Physicochemical characterization and catalytic performance of Fe doped CuS thin films deposited by the chemical spray pyrolysis technique

Applied physics. A, Materials science & processing, 2021-06, Vol.127 (6), Article 441

2021

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First-principles study of BC7 monolayer an ultra-high capacity anode for lithium-ion and sodium-ion batteries applications

Materials chemistry and physics, 2021-01, Vol.257, p.123751, Article 123751

2021

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First-principles study of electronic, electrical and optical properties of HoMn2O5

Journal of physics. Conference series, 2016, Vol.758 (1)

2016

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Interdistance Effects on Flat and Buckled Silicene Like-bilayers

Journal of physics. Conference series, 2014-03, Vol.491 (1), p.12006-8

2014

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Hydrogen molecule capacity physisorption on BC3 monolayer: First-principles calculations

Diamond and related materials, 2021-11, Vol.119, p.108583, Article 108583

2021

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Optical conductivity enhancement and band gap opening with silicon doped graphene

Carbon (New York), 2015-11, Vol.94, p.1021-1027

2015

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Magnetocaloric effect and electrical properties of (0.95)La0.45Nd0.25Sr0.3MnO3/(0.05)CuO composites

Materials research express, 2020-06, Vol.7 (6), p.066102

2020

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Kinetic Monte Carlo and density functional study of hydrogen diffusion in magnesium hydride MgH2

International journal of hydrogen energy, 2013-07, Vol.38 (20), p.8350-8356

2013

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Electronic and optical properties of organic-inorganic (CuII /ReVII)-heterobimetallic L-Arginine complex: Experimental and Computational studies

Journal of molecular structure, 2021-12, Vol.1246, p.131153, Article 131153

2021

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Hydrogen storage properties of perovskite-type MgCoH₃ under strain effect

Materials chemistry and physics, 2020-11, Vol.254, p.123417, Article 123417

2020

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Prediction of superconductivity in Li, K, Ca, and Sr-intercalated blue phosphorene bilayer using first-principle calculations

Journal of physics. Condensed matter, 2023-02, Vol.35 (13), p.135601

2023

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Crystal Field Effects on Magnetic Properties of a Mixed Ferrimagnetic Ising System: a Monte Carlo Study

Journal of superconductivity and novel magnetism, 2018-12, Vol.31 (12), p.4179-4184

2018

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The hydrogen ab/desorption kinetic properties of doped magnesium hydride MgH2 systems by first principles calculations and kinetic Monte Carlo simulations

International journal of hydrogen energy, 2015-05, Vol.40 (18), p.6137-6144

2015

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Influence of synthesis methods with low annealing temperature on the structural and magnetic properties of CoFe2O4 nanopowders for permanent magnet application

Journal of magnetism and magnetic materials, 2020-04, Vol.500, p.166416, Article 166416

2020

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Hysteresis Cycle and Magnetization Behaviors of a Mixed-Spin (7/2, 3/2) Ferrimagnetic Ising Model: Monte Carlo Investigation

Journal of superconductivity and novel magnetism, 2019-08, Vol.32 (8), p.2539-2550

2019

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Effects of double substitution on MgH2 hydrogen storage properties: An Ab initio study

Journal of alloys and compounds, 2018-04, Vol.743, p.666-671

2018

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DFT study of Se and Te doped SrTiO3 for enhanced visible-light driven phtocatalytic hydrogen production

Optical and quantum electronics, 2021-10, Vol.53 (10), Article 589

2021

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First-principles study of closo-dodecaborates M2B12H12 (M = Li, Na, K) as solid-state electrolyte materials

Prediction of magnetoelectric properties of defect BiFeO3 thin films using Monte Carlo simulations

First-principles prediction of the magnetism of 4f rare-earth-metal-doped wurtzite zinc oxide

An easy route to synthesize high-quality black phosphorus from amorphous red phosphorus

Chemical synthesis and magnetic properties of monodisperse cobalt ferrite nanoparticles

Effect of metal and non metal doping of TiO2 on photocatalytic activities: ab initio calculations

Theoretical investigation of FAPbSnGeX3 efficiency

Tunable maximum energy product in CoFe2O4 nanopowder for permanent magnet application

Physicochemical characterization and catalytic performance of Fe doped CuS thin films deposited by the chemical spray pyrolysis technique

First-principles study of BC7 monolayer an ultra-high capacity anode for lithium-ion and sodium-ion batteries applications

First-principles study of electronic, electrical and optical properties of HoMn2O5

Interdistance Effects on Flat and Buckled Silicene Like-bilayers

Hydrogen molecule capacity physisorption on BC3 monolayer: First-principles calculations

Optical conductivity enhancement and band gap opening with silicon doped graphene

Magnetocaloric effect and electrical properties of (0.95)La0.45Nd0.25Sr0.3MnO3/(0.05)CuO composites

Kinetic Monte Carlo and density functional study of hydrogen diffusion in magnesium hydride MgH2

Electronic and optical properties of organic-inorganic (CuII /ReVII)-heterobimetallic L-Arginine complex: Experimental and Computational studies

Hydrogen storage properties of perovskite-type MgCoH₃ under strain effect

Prediction of superconductivity in Li, K, Ca, and Sr-intercalated blue phosphorene bilayer using first-principle calculations

Crystal Field Effects on Magnetic Properties of a Mixed Ferrimagnetic Ising System: a Monte Carlo Study

The hydrogen ab/desorption kinetic properties of doped magnesium hydride MgH2 systems by first principles calculations and kinetic Monte Carlo simulations

Influence of synthesis methods with low annealing temperature on the structural and magnetic properties of CoFe2O4 nanopowders for permanent magnet application

Hysteresis Cycle and Magnetization Behaviors of a Mixed-Spin (7/2, 3/2) Ferrimagnetic Ising Model: Monte Carlo Investigation

Effects of double substitution on MgH2 hydrogen storage properties: An Ab initio study

DFT study of Se and Te doped SrTiO3 for enhanced visible-light driven phtocatalytic hydrogen production

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