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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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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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A new high capacity cathode material for Li/Na-ion batteries: dihafnium sulfide (HfS)

Physical chemistry chemical physics : PCCP, 2023-01, Vol.25 (2), p.1114-1122

Kadioglu, Yelda

2023

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Ballistic transport and optical properties of a new half-metallic monolayer: Vanadium phosphide

Materials science & engineering. B, Solid-state materials for advanced technology, 2021-06, Vol.268, p.115111, Article 115111

Kadioglu, Yelda

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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Molecular adsorption properties of CO and H 2 O on Au-, Cu-, and Au x Cu y -doped MoS 2 monolayer

Applied surface science, 2017-12, Vol.425, p.246-253

2017

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Functionalisation of hexagonal boron phosphide (h-BP) monolayer via atomic adsorption

Philosophical magazine letters, 2020-03, Vol.100 (3), p.116-127

2020

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Molecular adsorption properties of CO and H2O on Au-, Cu-, and AuxCuy-doped MoS2 monolayer

Applied surface science, 2017-12, Vol.425, p.246-253

2017

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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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Tuning the electronic structure of RhX 3 (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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Tuning the electronic structure of RhX (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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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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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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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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Chemical and substitutional doping, and anti-site and vacancy formation in monolayer AlN and GaNElectronic supplementary information (ESI) available: Energy bands of patterned structures consisting of a single adatom adsorbed to each periodically repeating (2 × 2) supercell of h-AlN and h-GaN. The details about the specific hydrogenation geometries, which lead to dynamical instabilities and configurations of approach of H2 and O2 molecules, which lead to dissociation and physisorption. See DOI:

2018-06

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Effects of gold based dimers on structural and electronic properties of MoS2

Applied surface science, 2017-02, Vol.396, p.455-460

2017

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Strain effects on electronic and magnetic properties of the monolayer α - RuCl 3: A first-principles and Monte Carlo study

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

2019

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Interactions of insecticides with DNA–RNA bases and environmental conditions

International journal of computational materials science and engineering, 2023-12

2023

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Electronic structure, cohesive and magnetic properties of iridium oxide clusters adsorbed on graphene

Journal of molecular graphics & modelling, 2020-12, Vol.101, p.107726-107726, Article 107726

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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Ultra Small Fluorine Carbon Nanoclusters

Journal of innovative science and engineering, 2021-06

KADIOĞLU, Yelda

2021

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Columnar antiferromagnetic order of a MBene monolayer

Physical review. B, 2021-04, Vol.103 (14), Article 144424

2021

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T-ZrS nanoribbons: structure and electronic properties

Philosophical magazine (Abingdon, England), 2016-07, Vol.96 (20), p.2074-2087

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)

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

A new high capacity cathode material for Li/Na-ion batteries: dihafnium sulfide (HfS)

Ballistic transport and optical properties of a new half-metallic monolayer: Vanadium phosphide

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

Molecular adsorption properties of CO and H 2 O on Au-, Cu-, and Au x Cu y -doped MoS 2 monolayer

Functionalisation of hexagonal boron phosphide (h-BP) monolayer via atomic adsorption

Molecular adsorption properties of CO and H2O on Au-, Cu-, and AuxCuy-doped MoS2 monolayer

Functionalization of monolayer MoS2 with transition metal oxide nanoclusters

Tuning the electronic structure of RhX 3 (X = Cl, Br, I) nonmagnetic monolayers: effects of charge-injection and external strain

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

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

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

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

Effects of gold based dimers on structural and electronic properties of MoS2

Strain effects on electronic and magnetic properties of the monolayer α - RuCl 3: A first-principles and Monte Carlo study

Interactions of insecticides with DNA–RNA bases and environmental conditions

Electronic structure, cohesive and magnetic properties of iridium oxide clusters adsorbed on graphene

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

Ultra Small Fluorine Carbon Nanoclusters

Columnar antiferromagnetic order of a MBene monolayer

T-ZrS nanoribbons: structure and electronic properties

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