Nadire Nayir
Nadire Nayir
Istanbul Technical University/Physics Eng; 2D Crystal Consort.; The Pennsylvania State University
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Cited by
Atomically thin half-van der Waals metals enabled by confinement heteroepitaxy
N Briggs, B Bersch, Y Wang, J Jiang, RJ Koch, N Nayir, K Wang, ...
Nature materials 19 (6), 637-643, 2020
Multi-scale modeling of gas-phase reactions in metal-organic chemical vapor deposition growth of WSe2
Y Xuan, A Jain, S Zafar, R Lotfi, N Nayir, Y Wang, TH Choudhury, S Wright, ...
Journal of Crystal Growth 527, 125247, 2019
Illuminating Invisible Grain Boundaries in Coalesced Single-Orientation WS2 Monolayer Films
D Reifsnyder Hickey, N Nayir, M Chubarov, TH Choudhury, S Bachu, ...
Nano letters 21 (15), 6487-6495, 2021
INDEEDopt: a deep learning-based ReaxFF parameterization framework
MY Sengul, Y Song, N Nayir, Y Gao, Y Hung, T Dasgupta, ACT van Duin
npj Computational Materials 7 (1), 68, 2021
Development of the ReaxFF reactive force field for inherent point defects in the Si/silica system
N Nayir, ACT Van Duin, S Erkoc
The Journal of Physical Chemistry A 123 (19), 4303-4313, 2019
Recent Advances in 2D Material Theory, Synthesis, Properties, and Applications
YC Lin, R Torsi, R Younas, CL Hinkle, AF Rigosi, HM Hill, K Zhang, ...
ACS nano, 2023
Modeling for Structural Engineering and Synthesis of Two-Dimensional WSe2 Using a Newly Developed ReaxFF Reactive Force Field
N Nayir, Y Wang, S Shabnam, DR Hickey, L Miao, X Zhang, S Bachu, ...
The Journal of Physical Chemistry C 124 (51), 28285-28297, 2020
Development and applications of ReaxFF reactive force fields for group-III gas-phase precursors and surface reactions with graphene in metal–organic chemical vapor deposition …
S Rajabpour, Q Mao, N Nayir, JA Robinson, ACT Van Duin
The Journal of Physical Chemistry C 125 (19), 10747-10758, 2021
Development of a ReaxFF Reactive Force Field for Interstitial Oxygen in Germanium and Its Application to GeO2/Ge Interfaces
N Nayir, ACT Van Duin, S Erkoc
The Journal of Physical Chemistry C 123 (2), 1208-1218, 2018
Theoretical modeling of edge-controlled growth kinetics and structural engineering of 2D-MoSe2
N Nayir, Y Wang, Y Ji, TH Choudhury, JM Redwing, LQ Chen, VH Crespi, ...
Materials Science and Engineering: B 271, 115263, 2021
Step engineering for nucleation and domain orientation control in WSe2 epitaxy on c-plane sapphire
H Zhu, N Nayir, TH Choudhury, A Bansal, B Huet, K Zhang, AA Puretzky, ...
Nature nanotechnology 18 (11), 1295-1302, 2023
Atomic-scale probing of defect-assisted Ga intercalation through graphene using ReaxFF molecular dynamics simulations
N Nayir, MY Sengul, AL Costine, P Reinke, S Rajabpour, A Bansal, ...
Carbon 190, 276-290, 2022
A ReaxFF Force Field for 2D-WS2 and Its Interaction with Sapphire
N Nayir, YK Shin, Y Wang, MY Sengul, DR Hickey, M Chubarov, ...
The Journal of Physical Chemistry C 125 (32), 17950-17961, 2021
A computational framework for guiding the MOCVD-growth of wafer-scale 2D materials
K Momeni, Y Ji, N Nayir, N Sakib, H Zhu, S Paul, TH Choudhury, ...
npj Computational Materials 8 (1), 240, 2022
Role of tilt grain boundaries on the structural integrity of WSe 2 monolayers
N Sakib, S Paul, N Nayir, ACT Van Duin, S Neshani, K Momeni
Physical Chemistry Chemical Physics 24 (44), 27241-27249, 2022
Modeling and simulations for 2D materials: a ReaxFF perspective
N Nayir, Q Mao, T Wang, M Kowalik, Y Zhang, M Wang, S Dwivedi, ...
2D Materials, 2023
Toward a Mechanistic Understanding of the Formation of 2D-GaNx in Epitaxial Graphene
A Bansal, N Nayir, K Wang, P Rondomanski, S Subramanian, S Kumari, ...
ACS nano 17 (1), 230-239, 2022
Density functional study of Ga intercalation at graphene/SiC heterointerface
N Nayir
Journal of Materials Research 37 (6), 1172-1182, 2022
Structural and Thermal Properties of Indium Phosphide Nanoparticles: Molecular Dynamics Simulations
N Nayir, ES Tasci, Ş Erkoç
Journal of Computational and Theoretical Nanoscience 12 (9), 2134-2139, 2015
Self-limiting stoichiometry in SnSe thin films
JR Chin, MB Frye, DSH Liu, M Hilse, IC Graham, J Shallenberger, ...
Nanoscale, 2023
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