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A theoretical investigation on optoelectronic and photocatalytic behaviour of Janus X-Ga-Al-Y (X, YS and Te) monolayers

Solid state communications, 2023-12, Vol.375, p.115347, Article 115347

2023

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Optoelectronic properties of 2D heterojunction ZrO2– MoS2 material using first-principles calculations

Solid state communications, 2021-08, Vol.334-335, p.114358, Article 114358

2021

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Impact of Strain on Electronic and Optical Properties of MgClBr Monolayer: First-principle Calculation

Computational and theoretical chemistry, 2023-10, Vol.1228, p.114278, Article 114278

2023

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First-principles calculations to investigate structural and electronic properties of novel halides ZrIX (X = Cl, Br) for photovoltaic application

Physica. B, Condensed matter, 2024-01, Vol.673, p.415499, Article 415499

2024

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A computational study on strain dependent photocatalytic activity of Janus Ga-Al-X-Se (X = S and Se) monolayers

Computational materials science, 2024-03, Vol.236, p.112861, Article 112861

2024

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Bulk and monolayer As2S3 as promising thermoelectric material with high conversion performance

Computational materials science, 2020-10, Vol.183, p.109913, Article 109913

2020

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Pressure Induced Structural, Electronic and Optical Properties of Sc2CBr2 MXene Monolayer: A Density Functional Approach

Computational and theoretical chemistry, 2024-02, Vol.1232, p.114466, Article 114466

2024

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A comparative study of structural, mechanical, electronic and optical properties of InTe monolayer & homo-bilayer

Physica. B, Condensed matter, 2024-07, Vol.685, p.416033, Article 416033

2024

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Theoretical investigations of asymmetric functionalized Y2C-based MXene monolayers

Solid state communications, 2023-10, Vol.372, p.115303, Article 115303

2023

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Theoretical exploration of PtSSe/ZrS2 Van der Waals heterostructure for solar energy conversion

Physica. B, Condensed matter, 2024-09, Vol.689, p.416165, Article 416165

2024

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MgF2 monolayer as an anti-reflecting material

Solid state communications, 2017-02, Vol.252, p.22-28

2017

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Strain dependent electronic transport of pristine Si and Ge nanowires

Computational materials science, 2021-02, Vol.188, p.110181, Article 110181

2021

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Structural and electrical properties of CeO2 monolayers using first-principles calculations

Solid state communications, 2020-02, Vol.307, p.113801, Article 113801

2020

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Structural And Electronic Properties of PtSe2/GaP Heterostructure

Materials today : proceedings, 2022, Vol.67, p.161-164

2022

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Strain dependent structural and electronic properties of two-dimensional janus In2SeTe monolayer

Materials today : proceedings, 2022, Vol.67, p.259-262

2022

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A GaAlS2 Janus Monolayer as a Promising Candidate for Optoelectronic Devices

Materials today : proceedings, 2023-02

2023

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Structural, Electronic, and Optical Properties of SnBr2 Monolayer by Density Functional Approach

Materials today : proceedings, 2023-02

2023

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Impact of stacking on the optoelectronic properties of 2D ZrS2/GaS heterostructure

Materials today : proceedings, 2021, Vol.47, p.526-528

2021

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Strain Engineering of Sc2CBr2 MXene Monolayer by First Principle Approach

Materials today : proceedings, 2023-02

2023

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Optoelectronic properties of 2D van der Waals heterostructure As/PtS2 by first-principles calculations

Materials today : proceedings, 2022, Vol.67 (Part 1), p.250-253

2022

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2D MgF2 nanosheet as a promising candidate for thermoelectric material

Materials today : proceedings, 2021, Vol.47, p.555-558

2021

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Structural and electrical properties of TiO2 monolayers using first-principle calculations

Materials today : proceedings, 2021, Vol.47, p.563-566

2021

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Effect of passivity on ultrathin Si nanowire: A density functional approach

Materials today : proceedings, 2021, Vol.47, p.559-562

2021

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MgF 2 monolayer as an anti-reflecting material

Solid state communications, 2017-02, Vol.252, p.22-28

2017

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Structure of Some 4f Rare Earth Liquid Metals --A Charged Hard Sphere Approach

Communications in theoretical physics, 2006-08, Vol.46 (2), p.337-342

2006

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A theoretical investigation on optoelectronic and photocatalytic behaviour of Janus X-Ga-Al-Y (X, YS and Te) monolayers

Optoelectronic properties of 2D heterojunction ZrO2– MoS2 material using first-principles calculations

Impact of Strain on Electronic and Optical Properties of MgClBr Monolayer: First-principle Calculation

First-principles calculations to investigate structural and electronic properties of novel halides ZrIX (X = Cl, Br) for photovoltaic application

A computational study on strain dependent photocatalytic activity of Janus Ga-Al-X-Se (X = S and Se) monolayers

Bulk and monolayer As2S3 as promising thermoelectric material with high conversion performance

Pressure Induced Structural, Electronic and Optical Properties of Sc2CBr2 MXene Monolayer: A Density Functional Approach

A comparative study of structural, mechanical, electronic and optical properties of InTe monolayer & homo-bilayer

Theoretical investigations of asymmetric functionalized Y2C-based MXene monolayers

Theoretical exploration of PtSSe/ZrS2 Van der Waals heterostructure for solar energy conversion

MgF2 monolayer as an anti-reflecting material

Strain dependent electronic transport of pristine Si and Ge nanowires

Structural and electrical properties of CeO2 monolayers using first-principles calculations

Structural And Electronic Properties of PtSe2/GaP Heterostructure

Strain dependent structural and electronic properties of two-dimensional janus In2SeTe monolayer

A GaAlS2 Janus Monolayer as a Promising Candidate for Optoelectronic Devices

Structural, Electronic, and Optical Properties of SnBr2 Monolayer by Density Functional Approach

Impact of stacking on the optoelectronic properties of 2D ZrS2/GaS heterostructure

Strain Engineering of Sc2CBr2 MXene Monolayer by First Principle Approach

Optoelectronic properties of 2D van der Waals heterostructure As/PtS2 by first-principles calculations

2D MgF2 nanosheet as a promising candidate for thermoelectric material

Structural and electrical properties of TiO2 monolayers using first-principle calculations

Effect of passivity on ultrathin Si nanowire: A density functional approach

MgF 2 monolayer as an anti-reflecting material

Structure of Some 4f Rare Earth Liquid Metals --A Charged Hard Sphere Approach

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