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High-capacity hydrogen storage in Li-decorated (AlN)n (n = 12, 24, 36) nanocages

International journal of hydrogen energy, 2014-03, Vol.39 (8), p.3780-3789

2014

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Strain-Tunable Visible-Light-Responsive Photocatalytic Properties of Two-Dimensional CdS/g-C₃N₄: A Hybrid Density Functional Study

Nanomaterials (Basel, Switzerland), 2019-02, Vol.9 (2), p.244

2019

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Superalkali halide perovskites with suitable direct band gaps for photovoltaic applications

Nanoscale, 2024-03, Vol.16 (1), p.513-5136

2024

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Magnetism and half-metallicity in bulk and (100) surface of Heusler alloy Ti2CoAl with Hg2CuTi-type structure

Journal of alloys and compounds, 2013-04, Vol.557, p.202-208

2013

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Tunable magnetism and half-metallicity in bulk and (1 0 0) surface of quaternary Co2MnGe1−xGax Heusler alloy

Journal of physics. D, Applied physics, 2011-10, Vol.44 (40), p.405301

2011

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Thermodynamic stability, magnetism and half-metallicity of Heusler alloy Co2MnX(X=Si, Ge, Sn)(100) surface

Applied surface science, 2012-03, Vol.258 (11), p.4945-4951

2012

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Quasi-2D lead-free halide perovskite using superalkali cations for red-light-emitting diodes

Nanoscale, 2021-08, Vol.13 (3), p.13152-13157

2021

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Spin alignment and magnetic phase transition in Cu-doped half-Heusler compound PdMnSb

Computational materials science, 2013-10, Vol.78, p.123-128

2013

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Inhibiting the decomposition of methylammonium using cations with low deprotonation energy

Journal of materials chemistry. A, Materials for energy and sustainability, 2022-11, Vol.1 (42), p.22742-22749

2022

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First-principles study of manganese adsorption on Si(1 0 0) surface

Applied surface science, 2009-04, Vol.255 (13), p.6624-6628

2009

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Biaxial strain tunable photocatalytic properties of 2D ZnO/GeC heterostructure

Journal of physics. D, Applied physics, 2020-01, Vol.53 (1), p.15104

2020

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A two-dimensional CdO/CdS heterostructure used for visible light photocatalysis

Physical chemistry chemical physics : PCCP, 2020-05, Vol.22 (17), p.9587-9592

2020

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Passivating Lead Halide Perovskites Using Pyridinium Salts with Superhalogen Atoms

The journal of physical chemistry letters, 2022-07, Vol.13 (26), p.6074-6078

2022

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Bilayer MoTe2/XS2 (X = Hf,Sn,Zr) heterostructures with efficient carrier separation and light absorption for photocatalytic water splitting into hydrogen

Applied surface science, 2021-04, Vol.544, p.148842, Article 148842

2021

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Adsorption and decomposition of metal decorated phosphorene toward H2S, HCN and NH3 molecules

Applied surface science, 2019-04, Vol.473, p.242-250

2019

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Acidic gases (CO2, NO2 and SO2) capture and dissociation on metal decorated phosphorene

Applied surface science, 2017-07, Vol.410, p.505-512

2017

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Bandgap engineering and charge separation in two-dimensional GaS-based van der Waals heterostructures for photocatalytic water splitting

Applied surface science, 2018-05, Vol.439, p.374-379

2018

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A hybrid density functional study on the visible light photocatalytic activity of (Mo,Cr)-N codoped KNbO3

2015-01

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Strain-tunable electronic and optical properties in two dimensional GaSe/g-C3N4 van der Waals heterojunction as photocatalyst for water splitting

Physica. E, Low-dimensional systems & nanostructures, 2020-04, Vol.118, p.113896, Article 113896

2020

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ZnO/MoX2 (X = S, Se) composites used for visible light photocatalysis

RSC advances, 2018-01, Vol.8 (2), p.1828-1835

2018

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Double-Hole-Mediated Codoping on KNbO3 for Visible Light Photocatalysis

Inorganic chemistry, 2016-10, Vol.55 (19), p.9620-9631

2016

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The comparative study of XO2 (X = C, N, S) gases adsorption and dissociation on pristine and defective graphene supported Pt13

Materials chemistry and physics, 2020-06, Vol.247, p.122712, Article 122712

2020

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Enhancing visible light photocatalytic activity of KNbO $$_{3}$$ 3 by N–F passivated co-doping for hydrogen generation by water splitting

Journal of materials science, 2017-05, Vol.52 (9), p.5333-5344

2017

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BiOX/BiOY (X, Y = F, Cl, Br, I) superlattices for visible light photocatalysis applications

RSC advances, 2016-01, Vol.6 (94), p.9158-91516

2016

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Dehydrogenation of ammonia borane catalyzed by pristine and defective h-BN sheets

Applied surface science, 2016-01, Vol.362, p.562-571

2016

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High-capacity hydrogen storage in Li-decorated (AlN)n (n = 12, 24, 36) nanocages

Strain-Tunable Visible-Light-Responsive Photocatalytic Properties of Two-Dimensional CdS/g-C₃N₄: A Hybrid Density Functional Study

Superalkali halide perovskites with suitable direct band gaps for photovoltaic applications

Magnetism and half-metallicity in bulk and (100) surface of Heusler alloy Ti2CoAl with Hg2CuTi-type structure

Tunable magnetism and half-metallicity in bulk and (1 0 0) surface of quaternary Co2MnGe1−xGax Heusler alloy

Thermodynamic stability, magnetism and half-metallicity of Heusler alloy Co2MnX(X=Si, Ge, Sn)(100) surface

Quasi-2D lead-free halide perovskite using superalkali cations for red-light-emitting diodes

Spin alignment and magnetic phase transition in Cu-doped half-Heusler compound PdMnSb

Inhibiting the decomposition of methylammonium using cations with low deprotonation energy

First-principles study of manganese adsorption on Si(1 0 0) surface

Biaxial strain tunable photocatalytic properties of 2D ZnO/GeC heterostructure

A two-dimensional CdO/CdS heterostructure used for visible light photocatalysis

Passivating Lead Halide Perovskites Using Pyridinium Salts with Superhalogen Atoms

Bilayer MoTe2/XS2 (X = Hf,Sn,Zr) heterostructures with efficient carrier separation and light absorption for photocatalytic water splitting into hydrogen

Adsorption and decomposition of metal decorated phosphorene toward H2S, HCN and NH3 molecules

Acidic gases (CO2, NO2 and SO2) capture and dissociation on metal decorated phosphorene

Bandgap engineering and charge separation in two-dimensional GaS-based van der Waals heterostructures for photocatalytic water splitting

A hybrid density functional study on the visible light photocatalytic activity of (Mo,Cr)-N codoped KNbO3

Strain-tunable electronic and optical properties in two dimensional GaSe/g-C3N4 van der Waals heterojunction as photocatalyst for water splitting

ZnO/MoX2 (X = S, Se) composites used for visible light photocatalysis

Double-Hole-Mediated Codoping on KNbO3 for Visible Light Photocatalysis

The comparative study of XO2 (X = C, N, S) gases adsorption and dissociation on pristine and defective graphene supported Pt13

Enhancing visible light photocatalytic activity of KNbO $$_{3}$$ 3 by N–F passivated co-doping for hydrogen generation by water splitting

BiOX/BiOY (X, Y = F, Cl, Br, I) superlattices for visible light photocatalysis applications

Dehydrogenation of ammonia borane catalyzed by pristine and defective h-BN sheets

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