Sergey Levchenko - Dissemin

All papers authored by Sergey Levchenko

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2024 Pavel A. Sinitsyn, Edita M. Atoian, Stanislav S. Ivchenko, Egor M. Pazhetnov, Mikhail A. Volkov, Viktoria A. Nikitina, Vitaly V. Kuznetsov, Sergey V. Levchenko

Stable electrochemical urea oxidation on Ruddlesden–Popper oxide catalysts

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2023 Debalaya Sarker

, Zhong-Kang Han, Sergey V. Levchenko

Iterative cluster expansion approach for predicting the structure evolution of mixed Ruddelsden-Popper oxides La2−xSrxNi1−yFeyO4±δ

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Saeid Abedi

, Mahdi Tarighi Ahmadpour

, Samira Baninajarian

, Hamideh Kahnouji

, S. Javad Hashemifar

, Zhong-Kang Han

, Sergey V. Levchenko

Statistical analysis of the performance of a variety of first-principles schemes for accurate prediction of binary semiconductor band gaps

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This paper is made freely available by the publisher.

2022 Yun Liu

, Zhongkang Han, Sandy Gewinner, Wieland Schöllkopf

, Sergey V. Levchenko

, Helmut Kuhlenbeck

, Beatriz Roldan Cuenya, Beatriz Roldan Cuenya

Adatom Bonding Sites in a Nickel‐Fe₃O₄(001) Single‐Atom Model Catalyst and O₂ Reactivity Unveiled by Surface Action Spectroscopy with Infrared Free‐Electron Laser Light

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Christian Tantardini, Sebastian Kokott, Xavier Gonze, Sergey V. Levchenko

, Wissam A. Saidi

“Self-trapping” in solar cell hybrid inorganic-organic perovskite absorbers

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Aliaksei Mazheika

, Yang-Gang Wang, Rosendo Valero

, Francesc Viñes

, Francesc Illas

, Luca M. Ghiringhelli, Sergey V. Levchenko

, Matthias Scheffler

Artificial-intelligence-driven discovery of catalyst genes with application to CO2 activation on semiconductor oxides

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This paper was not found in any repository; the policy of its publisher is unknown or unclear.

2021 Yaqiong Zhong, Xiaojuan Hu, Debalaya Sarker, Sergey Levchenko

, Qingrui Xia, Liangliang Xu, Chao Yang, Zhongkang-K. Han, Jiaolin Cui

Data analytics accelerates the experimental discovery of new thermoelectric materials with extremely high figure of merit

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Jian Zhou, Zhongkang Han, Xingkun Wang, Huiyu Gai, Zongkun Chen, Tong Guo, Xianbiao Hou, Liangliang Xu, Xiaojuan Hu, Minghua Huang

, Sergey V. Levchenko

, Heqing Jiang

Discovery of Quantitative Electronic Structure‐OER Activity Relationship in Metal‐Organic Framework Electrocatalysts Using an Integrated Theoretical‐Experimental Approach

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Vasilii Vasilchenko, Sergey Levchenko

, Vasili Perebeinos

, Andriy Zhugayevych

Small Polarons in Two-Dimensional Pnictogens: A First-Principles Study

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Tushar Debnath

, Debalaya Sarker, He Huang, Zhong-Kang Han, Amrita Dey, Lakshminarayana Polavarapu

, Sergey V. Levchenko

, Jochen Feldmann

Coherent vibrational dynamics reveals lattice anharmonicity in organic–inorganic halide perovskite nanocrystals

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Maria K. Pogodaeva, Sergey V. Levchenko

, Vladimir P. Drachev, Ildar R. Gabitov

Dielectric function of six elemental metals

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Zhong-Kang Han, Debalaya Sarker, Runhai Ouyang, Aliaksei Mazheika

, Yi Gao

, Sergey V. Levchenko

Single-atom alloy catalysts designed by first-principles calculations and artificial intelligence

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Lukas Pielsticker

, Ioannis Zegkinoglou

, Zhong-Kang Han

, Juan J. Navarro, Sebastian Kunze, Osman Karslıoğlu

, Sergey V. Levchenko

, Beatriz Roldan Cuenya

Crystallographic Orientation Dependence of Surface Segregation and Alloying on PdCu Catalysts for CO₂ Hydrogenation

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Vladimir P. Drachev, Maria Pogodaeva, Sergey V. Levchenko

, Ali E. Aliev

Spin-Polarized Plasmonics: Fresh View on Magnetic Nanoparticles

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2020 Christopher Sutton, Sergey V. Levchenko

First-Principles Atomistic Thermodynamics and Configurational Entropy

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Zhong-Kang Han

, Debalaya Sarker, Maria Troppenz

, Santiago Rigamonti

, Claudia Draxl

, Wissam A. Saidi

, Sergey V. Levchenko

First-principles study of Pd-alloyed Cu(111) surface in hydrogen atmosphere at realistic temperatures

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Svenja M. Janke

, Mariana Rossi

, Sergey V. Levchenko

, Sebastian Kokott

, Matthias Scheffler, Volker Blum

Pentacene and Tetracene Molecules and Films on H/Si(111): Level Alignment from Hybrid Density Functional Theory

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2019 Paul S. Bagus, Connie J. Nelin, Xunhua Zhao, Sergey V. Levchenko

, Earl Davis, Xuefei Weng, Florian Späth, Christian Papp, Helmut Kuhlenbeck

, Hans-Joachim Freund

Revisiting surface core-level shifts for ionic compounds

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Ray Miyazaki, Naoki Nakatani, Sergey V. Levchenko

, Takuro Yokoya, Kiyotaka Nakajima

, Kenji Hara, Atsushi Fukuoka

, Jun-Ya Hasegawa

DFT Mechanistic Study on the Complete Oxidation of Ethylene by the Silica-Supported Pt Catalyst: C═C Activation via the Ethylene Dioxide Intermediate

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Sergey V. Levchenko

, Matthias Scheffler

Compact representation of one-particle wavefunctions and scalar fields obtained from electronic-structure calculations

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All papers authored by Sergey Levchenko