43 Publications (Page 1 of 2)
2024
Charge-transfer hyperbolic polaritons in α-MoO3/graphene heterostructures. Applied Physics Reviews
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Ionic‐Liquid‐Gating‐Induced Hydrogenation in Epitaxial Strontium Ferrite. Advanced Functional Materials
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Unveiling the Role of Termination Groups in Stabilizing MXenes in Contact with Water. The Journal of Physical Chemistry Letters
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2023
Simple local environment descriptors for accurate prediction of hydrogen absorption and migration in metal alloysKorostelev, Vladislav⋅Wagner, James and Klyukin, KonstantinAmerican Chemical Society (ACS)
Simple local environment descriptors for accurate prediction of hydrogen absorption and migration in metal alloys. Journal of Materials Chemistry A
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2022
Antisite Defects Stabilized by Antiphase Boundaries in YFeO3 Thin FilmsKumar, Abinash⋅Kumar, A.⋅Klyukin, Konstantin⋅Klyukin, K.⋅Ning, Shuai⋅Ning, S.⋅Ozsoy-Keskinbora, C.⋅Ozsoy-Keskinbora, Cigdem⋅Ovsyanko, M.⋅Ovsyanko, Mikhail⋅Uden, F.⋅Uden, Felix⋅Krijnen, R.⋅Krijnen, Ruud⋅Yildiz, Bilge⋅Yildiz, B.⋅Ross, C.A.⋅Ross, Caroline A.⋅Le Beau, James M. and LeBeau, J.M.Advanced Functional Materials, vol. 32.
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Controlling the carrier density of surface conductive diamondGeis, M.W.⋅Hollis, M.A.⋅Turner, G.W.⋅Daulton, J.⋅Varghese, J.O.⋅Klyukin, K.⋅Wang, J.⋅Yildiz, B. and Zhang, B.Diamond and Related Materials, vol. 122.
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2021
An antisite defect mechanism for room temperature ferroelectricity in orthoferritesNing, S.⋅Shuai, Ning⋅Ning, Shuai⋅Kumar, Abinash⋅Kumar, A.⋅Kumar, Abinash⋅Klyukin, K.⋅⋅Klyukin, Konstantin⋅Cho, Eunsoo⋅Cho, E.⋅Kim, Jong Heon⋅Kim, J.H.⋅Su, T.⋅Su, Tingyu⋅Hyun-Suk, Kim⋅Kim, H.-S.⋅Kim, Hyun-Suk⋅Le Beau, J.M.⋅LeBeau, James M⋅LeBeau, James M⋅⋅Yildiz, B.⋅Yildiz, Bilge⋅Ross, C.A.⋅Ross, Caroline A and Ross, Caroline ANature Communications.
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An antisite defect mechanism for room temperature ferroelectricity in orthoferritesNing, S.⋅Ning, S.⋅Kumar, A.⋅Kumar, A.⋅Klyukin, K.⋅Klyukin, K.⋅Kim, J.H.⋅Kim, J.H.⋅Su, T.⋅Su, T.⋅Kim, H.-S.⋅Kim, H.-S.⋅Le Beau, J.M.⋅LeBeau, J.M.⋅Yildiz, B.⋅Yildiz, B.⋅Ross, C.A. and Ross, C.A.
Antisite defects stabilized by antiphase boundaries in YFeO3 thin filmsKumar, A.⋅Kumar, A.⋅Klyukin, K.⋅Klyukin, K.⋅Ning, S.⋅Ning, S.⋅Ozsoy-Keskinbora, C.⋅Ozsoy-Keskinbora, C.⋅Ovsyanko, M.⋅Ovsyanko, M.⋅Uden, F.⋅Uden, F.⋅Krijnen, R.⋅Krijnen, R.⋅Yildiz, B.⋅Yildiz, B.⋅Ross, C.A.⋅Ross, C.A.⋅Le Beau, J.M. and LeBeau, J.M.
First-principles calculation of oxygen vacancy effects on the magnetic properties of the perovskiteCho, E.⋅Klyukin, K.⋅Ning, S.⋅Li, J.⋅Comin, R.⋅Green, R.J.⋅Yildiz, B. and Ross, C.A.Physical Review Materials, vol. 5.
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Layer-By-Layer Polyelectrolyte Assembly for the Protection of GaP Surfaces from PhotocorrosionRyzhkov, Nikolay V.⋅Ledovich, Olesya⋅Eggert, Lara⋅Bund, Andreas⋅Paszuk, Agnieszka⋅Hannappel, Thomas⋅Klyukin, Konstantin⋅Alexandrov, Vitaly and Skorb, Ekaterina V.ACS Applied Nano Materials, vol. 4, pp. 425–431.
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Straightforward strategy toward a shape-deformable carbon-free cathode for flexible Li–air batteries in ambient airJung, Ji-Won⋅Nam, Jong Seok⋅Klyukin, Konstantin⋅Youn, Doo-Young and Kim, Il-DooNano Energy, vol. 83, pp. 105821.
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Voltage control of ferrimagnetic order and voltage-assisted writing of ferrimagnetic spin texturesHuang, Mantao⋅Huang, Mantao⋅Hasan, Muhammad Usama⋅Hasan, Muhammad Usama⋅Klyukin, Konstantin⋅Klyukin, Konstantin⋅Zhang, Delin⋅Zhang, Delin⋅Lyu, Deyuan⋅Lyu, Deyuan⋅Gargiani, Pierluigi⋅Gargiani, Pierluigi⋅Valvidares, Manuel⋅Valvidares, Manuel⋅Sheffels, Sara⋅Sheffels, Sara⋅Churikova, Alexandra⋅Churikova, Alexandra⋅Büttner, Felix⋅Büttner, Felix⋅Zehner, Jonas⋅Zehner, Jonas⋅Caretta, Lucas⋅Caretta, Lucas⋅Lee, Ki-Young⋅Lee, Ki-Young⋅Chang, Joonyeon⋅Chang, Joonyeon⋅Wang, Jian-Ping⋅Wang, Jian-Ping⋅Leistner, Karin⋅Leistner, Karin⋅Yildiz, Bilge⋅Yildiz, Bilge⋅Beach, Geoffrey S D and Beach, Geoffrey S. D.Nature Nanotechnology.
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2020
Hydrogen tunes magnetic anisotropy by affecting local hybridization at the interface of a ferromagnet with nonmagnetic metalsKlyukin, Konstantin⋅Beach, Geoffrey and Yildiz, BilgePhysical Review Materials, vol. 4.
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Kinetics of pH‐dependent interactions between PD‐1 and PD‐L1 immune checkpoint proteins from molecular dynamics
Proteins: Structure, Function, and Bioinformatics. | Journal Article
Protonic solid-state electrochemical synapse for physical neural networksYao, Xiahui⋅Yao, Xiahui⋅Yao, Xiahui⋅Klyukin, Konstantin⋅Klyukin, Konstantin⋅Klyukin, Konstantin⋅Lu, Wenjie⋅Lu, Wenjie⋅Lu, Wenjie⋅Onen, Murat⋅Onen, Murat⋅Onen, Murat⋅Ryu, Seungchan⋅Ryu, Seungchan⋅Ryu, Seungchan⋅Kim, Dongha⋅Kim, Dongha⋅Kim, Dongha⋅Emond, Nicolas⋅Emond, Nicolas⋅Emond, Nicolas⋅Waluyo, Iradwikanari⋅Waluyo, Iradwikanari⋅Waluyo, Iradwikanari⋅Hunt, Adrian⋅Hunt, Adrian⋅Hunt, Adrian⋅Alamo, Jesús A.⋅Del Alamo, Jesús A⋅Del Alamo, Jesús A⋅Li, Ju⋅Li, Ju⋅Li, Ju⋅Yildiz, Bilge⋅Yildiz, Bilge and Yildiz, BilgeNature Communications, vol. 11.
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Short-Range Structure of Ti0.63V0.27Fe0.10D1.73 from Neutron Total Scattering and Reverse Monte Carlo Modelling
Energies. | Journal Article
2019
Ab Initio Modeling of Transition Metal Dissolution from the LiNi0.5Mn1.5O4 CathodeIntan, Nadia N.⋅Klyukin, Konstantin and Alexandrov, VitalyACS Applied Materials & Interfaces, vol. 11, pp. 20110–20116.
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Mechanistic Theoretical Investigation of Self-Discharge Reactions in a Vanadium Redox Flow BatteryJiang, Zhen⋅Klyukin, Konstantin⋅Miller, Kaellen and Alexandrov, VitalyThe Journal of Physical Chemistry B, vol. 123, pp. 3976–3983.
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Role of Dissolution Intermediates in Promoting Oxygen Evolution Reaction at RuO2(110) SurfaceKlyukin, Konstantin⋅Zagalskaya, Alexandra and Alexandrov, VitalyThe Journal of Physical Chemistry C, vol. 123, pp. 22151–22157.
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2018
Ab Initio Metadynamics Study of the VO2\mathplus/VO2\mathplus Redox Reaction Mechanism at the Graphite Edge/Water InterfaceJiang, Zhen⋅Klyukin, Konstantin and Alexandrov, VitalyACS Applied Materials & Interfaces, vol. 10, pp. 20621–20626.
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Ab Initio Thermodynamics of Iridium Surface Oxidation and Oxygen Evolution ReactionKlyukin, Konstantin⋅Zagalskaya, Alexandra and Alexandrov, VitalyThe Journal of Physical Chemistry C, vol. 122, pp. 29350–29358.
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Ab Initio Thermodynamics of Iridium Surface Oxidation and Oxygen Evolution ReactionKlyukin, Konstantin⋅Zagalskaya, Alexandra and Alexandrov, VitalyAmerican Chemical Society (ACS)
A combined theoretical-experimental study of interactions between vanadium ions and Nafion membrane in all-vanadium redox flow batteriesIntan, Nadia N.⋅Klyukin, Konstantin⋅Zimudzi, Tawanda J.⋅Hickner, Michael A. and Alexandrov, VitalyJournal of Power Sources, vol. 373, pp. 150–160.
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