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Chemical and substitutional doping, and anti-site and vacancy formation in monolayer AlN and GaN

Physical chemistry chemical physics : PCCP, 2018, Vol.20 (23), p.16077-16091

2018

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Exploring the electronic and magnetic properties of new metal halides from bulk to two-dimensional monolayer: RuX3 (X = Br, I)

Journal of magnetism and magnetic materials, 2019-04, Vol.476, p.111-119

2019

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Can Stable MoS2 Monolayers and Multilayers Be Constituted in the Biphenylene Network?

Journal of physical chemistry. C, 2023-05, Vol.127 (18), p.8770-8777

2023

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Interaction of Adatoms and Molecules with Single-Layer Arsenene Phases

Journal of physical chemistry. C, 2016-07, Vol.120 (26), p.14345-14355

2016

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Functional Carbon and Silicon Monolayers in Biphenylene Network

ACS applied electronic materials, 2022-06, Vol.4 (6), p.3056-3070

2022

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Adsorption and Diffusion of Lithium on Monolayer Transition Metal Dichalcogenides (MoS2(1–x)Se2x ) Alloys

Journal of physical chemistry. C, 2015-12, Vol.119 (51), p.28648-28653

2015

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Lateral Composite Structures of Graphene/Graphane/Graphone: Electronic Confinement, Heterostructures with Tunable Band Alignment, and Magnetic State

Journal of physical chemistry. C, 2023-08, Vol.127 (34), p.17239-17248

2023

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Enhanced Interactions of Amino Acids and Nucleic Acid Bases with Bare Black Phosphorene Monolayer Mediated by Coadsorbed Species

Journal of physical chemistry. C, 2019-09, Vol.123 (38), p.23691-23704

2019

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Functionalization of Single-Layer Nitrogene by Vacancy, Adatoms, and Molecules

Journal of physical chemistry. C, 2017-03, Vol.121 (11), p.6329-6338

2017

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Glycine self-assembled on graphene enhances the solar absorbance performance

Carbon (New York), 2019-03, Vol.143, p.329-334

2019

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Point defects in hexagonal germanium carbide monolayer: A first-principles calculation

Applied surface science, 2016-12, Vol.389, p.1-6

2016

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A tetragonal phase Mn2B2 sheet: a stable room temperature ferromagnet with sizable magnetic anisotropy

Physical chemistry chemical physics : PCCP, 2020-05, Vol.22 (19), p.10893-10899

2020

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Exploring the potential of MnX (S, Sb) monolayers for antiferromagnetic spintronics: A theoretical investigation

Journal of applied physics, 2020-09, Vol.128 (11)

2020

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Novel two-dimensional CrXB2 (X=Cr, Ru) metal for high Néel temperature antiferromagnetic spintronics

Journal of solid state chemistry, 2021-10, Vol.302, Article 122427

2021

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Doping‐Driven Antiferromagnetic to Ferromagnetic Phase Transition in Tetragonal Cr 2 B 2 Monolayer

physica status solidi (b), 2021-04, Vol.258 (4), p.n/a

2021

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Novel Metallic Clathrates of Group-IV Elements and Their Compounds in a Dense Hexagonal Lattice

Journal of physical chemistry. C, 2019-06, Vol.123 (24), p.15330-15338

2019

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Strain effects on electronic and magnetic properties of the monolayer α-RuCl3: A first-principles and Monte Carlo study

Journal of applied physics, 2019-02, Vol.125 (8)

2019

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Stability and electronic properties of monolayer and multilayer structures of group-IV elements and compounds of complementary groups in biphenylene network

Physical review. B, 2022-01, Vol.105 (3), Article 035408

2022

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Functionalization of monolayer MoS2 with transition metal oxide nanoclusters

Physica. B, Condensed matter, 2021-10, Vol.619, p.413245, Article 413245

2021

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Diffusion quantum Monte Carlo and density functional calculations of the structural stability of bilayer arsenene

The Journal of chemical physics, 2018-06, Vol.148 (21), p.214706-214706

2018

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First-principles and Monte Carlo investigation of magnetic properties of two-dimensional transition metal alloyed boron-carbide CrFeBC sheet

Computational materials science, 2022-02, Vol.202, Article 110964

2022

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Tuning the electronic structure of RhX3 (X = Cl, Br, I) nonmagnetic monolayers: effects of charge-injection and external strain

Physical chemistry chemical physics : PCCP, 2020-02, Vol.22 (8), p.4561-4573

2020

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Modification of electronic structure, magnetic structure, and topological phase of bismuthene by point defects

Physical review. B, 2017-12, Vol.96 (24), Article 245424

2017

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High uptake and fixation ability of BC monolayer for CO and NO toxic gases: a computational analysis

Journal of materials science, 2021-11, Vol.56 (33), p.18566-18580

2021

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Adsorption of alkali and alkaline-earth metal atoms on stanene: A first-principles study

Materials chemistry and physics, 2016-09, Vol.180, p.326-331

2016

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Chemical and substitutional doping, and anti-site and vacancy formation in monolayer AlN and GaN

Exploring the electronic and magnetic properties of new metal halides from bulk to two-dimensional monolayer: RuX3 (X = Br, I)

Can Stable MoS2 Monolayers and Multilayers Be Constituted in the Biphenylene Network?

Interaction of Adatoms and Molecules with Single-Layer Arsenene Phases

Functional Carbon and Silicon Monolayers in Biphenylene Network

Adsorption and Diffusion of Lithium on Monolayer Transition Metal Dichalcogenides (MoS2(1–x)Se2x ) Alloys

Lateral Composite Structures of Graphene/Graphane/Graphone: Electronic Confinement, Heterostructures with Tunable Band Alignment, and Magnetic State

Enhanced Interactions of Amino Acids and Nucleic Acid Bases with Bare Black Phosphorene Monolayer Mediated by Coadsorbed Species

Functionalization of Single-Layer Nitrogene by Vacancy, Adatoms, and Molecules

Glycine self-assembled on graphene enhances the solar absorbance performance

Point defects in hexagonal germanium carbide monolayer: A first-principles calculation

A tetragonal phase Mn2B2 sheet: a stable room temperature ferromagnet with sizable magnetic anisotropy

Exploring the potential of MnX (S, Sb) monolayers for antiferromagnetic spintronics: A theoretical investigation

Novel two-dimensional CrXB2 (X=Cr, Ru) metal for high Néel temperature antiferromagnetic spintronics

Doping‐Driven Antiferromagnetic to Ferromagnetic Phase Transition in Tetragonal Cr 2 B 2 Monolayer

Novel Metallic Clathrates of Group-IV Elements and Their Compounds in a Dense Hexagonal Lattice

Strain effects on electronic and magnetic properties of the monolayer α-RuCl3: A first-principles and Monte Carlo study

Stability and electronic properties of monolayer and multilayer structures of group-IV elements and compounds of complementary groups in biphenylene network

Functionalization of monolayer MoS2 with transition metal oxide nanoclusters

Diffusion quantum Monte Carlo and density functional calculations of the structural stability of bilayer arsenene

First-principles and Monte Carlo investigation of magnetic properties of two-dimensional transition metal alloyed boron-carbide CrFeBC sheet

Tuning the electronic structure of RhX3 (X = Cl, Br, I) nonmagnetic monolayers: effects of charge-injection and external strain

Modification of electronic structure, magnetic structure, and topological phase of bismuthene by point defects

High uptake and fixation ability of BC monolayer for CO and NO toxic gases: a computational analysis

Adsorption of alkali and alkaline-earth metal atoms on stanene: A first-principles study

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