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1

Microscopic Electrode Processes in the Four-Electron Oxygen Reduction on Highly-Active Carbon-based Electrocatalysts

Sakaushi, Ken, Eckardt, Markus, Lyalin, Andrey, Taketsugu, Tetsuya, Behm, R. Jürgen, Uosaki, Kohei

Journal:

Year:

2018

Language:

english

File:

PDF, 2.22 MB

english, 2018

2

Oxygen activation and dissociation on h-BN supported Au atoms

Min Gao, Andrey Lyalin, Tetsuya Taketsugu

Journal:

International Journal of Quantum Chemistry

Year:

2012

Language:

english

File:

PDF, 987 KB

english, 2012

3

Role of the Support Effects on the Catalytic Activity of Gold Clusters: A Density Functional Theory Study

Gao, Min, Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

Year:

2011

Language:

english

File:

PDF, 4.13 MB

english, 2011

4

CO oxidation on h-BN supported Au atom

Gao, Min, Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 1.04 MB

english, 2013

5

Evolution of the electronic and ionic structure of Mg clusters with increase in cluster size

Lyalin, Andrey, Solov’yov, Ilia A., Solov’yov, Andrey V., Greiner, Walter

Journal:

Physical Review A

Year:

2003

Language:

english

File:

PDF, 1.45 MB

english, 2003

6

A computational investigation of H2 adsorption and dissociation on Au nanoparticles supported on TiO2 surface

Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

Faraday Discussions

Year:

2011

Language:

english

File:

PDF, 599 KB

english, 2011

7

Adsorption of Ethylene on Neutral, Anionic, and Cationic Gold Clusters

Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry C

Year:

2010

Language:

english

File:

PDF, 2.23 MB

english, 2010

8

Reactant-Promoted Oxygen Dissociation on Gold Clusters

Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry Letters

Year:

2010

Language:

english

File:

PDF, 1.23 MB

english, 2010

9

Functionalization of Monolayer h-BN by a Metal Support for the Oxygen Reduction Reaction

Lyalin, Andrey, Nakayama, Akira, Uosaki, Kohei, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry C

Year:

2013

Language:

english

File:

PDF, 2.30 MB

english, 2013

10

Theoretical predictions for hexagonal BN based nanomaterials as electrocatalysts for the oxygen reduction reaction

Lyalin, Andrey, Nakayama, Akira, Uosaki, Kohei, Taketsugu, Tetsuya

Journal:

Physical Chemistry Chemical Physics

Year:

2013

Language:

english

File:

PDF, 2.82 MB

english, 2013

11

Structure and magnetism of lanthanum clusters

Lyalin, Andrey, Solov’yov, Andrey V., Greiner, Walter

Journal:

Physical Review A

Year:

2006

Language:

english

File:

PDF, 701 KB

english, 2006

12

Adsorption and Catalytic Activation of the Molecular Oxygen on the Metal Supported h-BN

Lyalin, Andrey, Nakayama, Akira, Uosaki, Kohei, Taketsugu, Tetsuya

Journal:

Topics in Catalysis

Year:

2014

Language:

english

File:

PDF, 2.50 MB

english, 2014

13

Boron Nitride Nanosheet on Gold as an Electrocatalyst for Oxygen Reduction Reaction: Theoretical Suggestion and Experimental Proof

Uosaki, Kohei, Elumalai, Ganesan, Noguchi, Hidenori, Masuda, Takuya, Lyalin, Andrey, Nakayama, Akira, Taketsugu, Tetsuya

Journal:

Journal of the American Chemical Society

Year:

2014

Language:

english

File:

PDF, 1.81 MB

english, 2014

14

Application of Automated Reaction Path Search Methods to a Systematic Search of Single-Bond Activation Pathways Catalyzed by Small Metal Clusters: A Case Study on H–H Activation by Gold

Gao, Min, Lyalin, Andrey, Maeda, Satoshi, Taketsugu, Tetsuya

Journal:

Journal of Chemical Theory and Computation

Year:

2014

Language:

english

File:

PDF, 393 KB

english, 2014

15

Comparative study of metal-cluster fission in Hartree-Fock and local-density approximations

Lyalin, Andrey, Solov’yov, Andrey, Greiner, Walter

Journal:

Physical Review A

Year:

2002

Language:

english

File:

PDF, 125 KB

english, 2002

16

Catalytic Activity of Au and Au 2 on the h-BN Surface: Adsorption and Activation of O 2

Gao, Min, Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry C

Year:

2012

Language:

english

File:

PDF, 2.49 MB

english, 2012

17

Cooperative Adsorption of O 2 and C 2 H 4 on Small Gold Clusters

Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry C

Year:

2009

Language:

english

File:

PDF, 517 KB

english, 2009

18

Hartree-Fock approach for metal-cluster fission

Lyalin, Andrey, Solov’yov, Andrey, Greiner, Walter, Semenov, Sergey

Journal:

Physical Review A

Year:

2002

Language:

english

File:

PDF, 63 KB

english, 2002

19

Interplay of electronic and geometry shell effects in properties of neutral and charged Sr clusters

Lyalin, Andrey, Solov’yov, Ilia A., Solov’yov, Andrey V., Greiner, Walter

Journal:

Physical Review A

Year:

2007

Language:

english

File:

PDF, 1.22 MB

english, 2007

20

Impurity effect on the melting of nickel clusters as seen via molecular dynamics simulations

Lyalin, Andrey, Hussien, Adilah, Solov’yov, Andrey V., Greiner, Walter

Journal:

Physical Review B

Year:

2009

Language:

english

File:

PDF, 2.17 MB

english, 2009

21

ON THE APPLICABILITY OF THE JELLIUM MODEL TO THE DESCRIPTION OF ALKALI CLUSTERS

MATVEENTSEV, ANTON, LYALIN, ANDREY, SOLOV'YOV, ILIA A., SOLOV'YOV, ANDREY V., GREINER, WALTER

Journal:

International Journal of Modern Physics E

Year:

2003

Language:

english

File:

PDF, 1.04 MB

english, 2003

22

Reactivity of Gold Clusters in the Regime of Structural Fluxionality

Gao, Min, Lyalin, Andrey, Takagi, Makito, Maeda, Satoshi, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry C

Year:

2015

Language:

english

File:

PDF, 2.12 MB

english, 2015

23

The h-BN surface effect on CO oxidation reaction catalyzed by supported gold atom

Gao, Min, Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

Journal of Physics Conference Series

Year:

2013

Language:

english

File:

PDF, 2.26 MB

english, 2013

24

SPIE Proceedings [SPIE Saratov Fall Meeting 2013 - Saratov, Russian Federation (Tuesday 24 September 2013)] Saratov Fall Meeting 2013: Optical Technologies in Biophysics and Medicine XV; and Laser Physics and Photonics XV - The study of coastal meromictic water basins in the Kandalaksha Gulf of the White Sea by spectral and physicochemical methods

Genina, Elina A., Derbov, Vladimir L., Meglinski, Igor, Tuchin, Valery V., Kharcheva, Anastasia V., Meschankin, Andrey V., Lyalin, Igor I., Krasnova, Elena D., Voronov, Dmitry A., Patsaeva, Svetlana V

Year:

2014

Language:

english

File:

PDF, 769 KB

english, 2014

25

Hartree-Fock deformed jellium model for metallic clusters

Lyalin, Andrey G, Semenov, Sergey K, Solov'yov, Andrey V, Cherepkov, Nikolai A, Greiner, Walter

Journal:

Journal of Physics B Atomic Molecular and Optical Physics

Year:

2000

Language:

english

File:

PDF, 149 KB

english, 2000

26

Gold nanoparticle decoration of insulating boron nitride nanosheet on inert gold electrode toward an efficient electrocatalyst for the reduction of oxygen to water

Elumalai, Ganesan, Noguchi, Hidenori, Lyalin, Andrey, Taketsugu, Tetsuya, Uosaki, Kohei

Journal:

Electrochemistry Communications

Year:

2016

Language:

english

File:

PDF, 977 KB

english, 2016

27

Long Range Functionalization of H-BN Monolayer by Carbon Doping

Gao, Min, Adachi, Masashi, Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry C

Year:

2016

Language:

english

File:

PDF, 3.65 MB

english, 2016

28

Hartree-Fock Deformed Jellium Calculations for Metallic Clusters

Lyalin, Andrey, Semenov, Sergey, Solov'Yov, Andrey, Cherepkov, Nikolai, Connerade, Jean-Patrick, Greiner, Walter

Journal:

Journal of the Chinese Chemical Society

Year:

2001

File:

PDF, 637 KB

2001

29

When Inert Becomes Active: A Fascinating Route for Catalyst Design

Lyalin, Andrey, Gao, Min, Taketsugu, Tetsuya

Journal:

The Chemical Record

Year:

2016

Language:

english

File:

PDF, 961 KB

english, 2016

30

Highly Efficient Electrochemical Hydrogen Evolution Reaction at Insulating Boron Nitride Nanosheet on Inert Gold Substrate

Uosaki, Kohei, Elumalai, Ganesan, Dinh, Hung Cuong, Lyalin, Andrey, Taketsugu, Tetsuya, Noguchi, Hidenori

Journal:

Scientific Reports

Year:

2016

Language:

english

File:

PDF, 541 KB

english, 2016

31

Atomically Thin Hexagonal Boron Nitride Nanofilm for Cu Protection: The Importance of Film Perfection

Khan, Majharul Haque, Jamali, Sina S., Lyalin, Andrey, Molino, Paul J., Jiang, Lei, Liu, Hua Kun, Taketsugu, Tetsuya, Huang, Zhenguo

Journal:

Advanced Materials

Year:

2016

Language:

english

File:

PDF, 1.76 MB

english, 2016

32

ChemInform Abstract: When Inert Becomes Active: A Fascinating Route for Catalyst Design

Lyalin, Andrey, Gao, Min, Taketsugu, Tetsuya

Journal:

Year:

2016

File:

PDF, 16 KB

2016

33

Interface Effects in Hydrogen Elimination Reaction from Isopropanol by Ni 13 Cluster on θ-Al 2 O 3 (010) Surface

Lyalin, Andrey, Shimizu, Ken-ichi, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry C

Year:

2017

Language:

english

File:

PDF, 4.83 MB

english, 2017

34

Isomerization in Gold Clusters upon O 2 Adsorption

Gao, Min, Horita, Daisuke, Ono, Yuriko, Lyalin, Andrey, Maeda, Satoshi, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry C

Year:

2017

Language:

english

File:

PDF, 1.99 MB

english, 2017

35

Two-Dimensional Corrugated Porous Carbon-, Nitrogen-Framework/Metal Heterojunction for Efficient Multielectron Transfer Processes with Controlled Kinetics

Sakaushi, Ken, Lyalin, Andrey, Tominaka, Satoshi, Taketsugu, Tetsuya, Uosaki, Kohei

Journal:

Year:

2017

Language:

english

File:

PDF, 5.97 MB

english, 2017

36

Oxygen Reduction Reaction Catalyzed by Small Gold Cluster on h-BN/Au(111) Support

Lyalin, Andrey, Uosaki, Kohei, Taketsugu, Tetsuya

Journal:

Electrocatalysis

Year:

2017

Language:

english

File:

PDF, 1.44 MB

english, 2017

37

Excess Charge Driven Dissociative Hydrogen Adsorption on Ti 2 O 4 ˉ

Song, Xiaowei, Fagiani, Matias Ruben, Debnath, Sreekanta, Gao, Min, Maeda, Satoshi, Taketsugu, Tetsuya, Gewinner, Sandy, Schöllkopf, Wieland, Asmis, Knut R., Lyalin, Andrey

Journal:

Physical Chemistry Chemical Physics

Year:

2017

Language:

english

File:

PDF, 1.54 MB

english, 2017

38

AIP Conference Proceedings [AIP THE FOURTH INTERNATIONAL SYMPOSIUM “ATOMIC CLUSTER COLLISIONS: STRUCTURE AND DYNAMICS FROM THE NUCLEAR TO THE BIOLOGICAL SCALE” (ISACC 2009) - Ann Arbor (Michigan) (14–18 July 2009)] - Catalitic Activity of Gold Clusters

Lyalin, Andrey, Taketsugu, Tetsuya, Solov́yov, Andrey, Surdutovich, Eugene

Year:

2009

Language:

english

File:

PDF, 387 KB

english, 2009

39

Lithiation Products of Silicon Anode Based on Soft X-ray Emission Spectroscopy: A Theoretical Study

Lyalin, Andrey, Kuznetsov, Vladimir G., Nakayama, Akira, Abarenkov, Igor V., Tupitsyn, Ilya I., Gabis, Igor E., Uosaki, Kohei, Taketsugu, Tetsuya

Journal:

The Journal of Physical Chemistry C

Year:

2018

Language:

english

File:

PDF, 3.29 MB

english, 2018

40

Quantum-to-Classical Transition of Proton Transfer in Potential-Induced Dioxygen Reduction

Sakaushi, Ken, Lyalin, Andrey, Taketsugu, Tetsuya, Uosaki, Kohei

Journal:

Physical Review Letters

Year:

2018

Language:

english

File:

PDF, 488 KB

english, 2018

41

CO 2 Adsorption on Ti 3 O 6 ˉ: A Novel Carbonate Binding Motif

Debnath, Sreekanta, Song, Xiaowei, Fagiani, Matias R., Weichman, Marissa L., Gao, Min, Maeda, Satoshi, Taketsugu, Tetsuya, Schöllkopf, Wieland, Lyalin, Andrey, Neumark, Daniel M., Asmis, Knut R.

Journal:

The Journal of Physical Chemistry C

Year:

2018

Language:

english

File:

PDF, 8.03 MB

english, 2018

42

A Combined Automated Reaction Pathway Searches and Sparse Modeling Analysis for Catalytic Properties of Lowest Energy Twins of Cu 13

Iwasa, Takeshi, Sato, Takaaki, Takagi, Makito, Gao, Min, Lyalin, Andrey, Kobayashi, Masato, Shimizu, Ken-Ichi, Maeda, Satoshi, Taketsugu, Tetsuya

Journal:

Journal of Physical Chemistry A

Year:

2018

Language:

english

File:

PDF, 646 KB

english, 2018

43

Observations and theories of quantum effects in proton transfer electrode processes

Sakaushi, Ken, Lyalin, Andrey, Taketsugu, Tetsuya

Journal:

Current Opinion in Electrochemistry

Year:

2019

Language:

english

File:

PDF, 8.91 MB

english, 2019

44

Single-Phase Borophene on Ir(111): Formation, Structure, and Decoupling from the Support

Vinogradov, Nikolay A., Lyalin, Andrey, Taketsugu, Tetsuya, Vinogradov, Alexander S., Preobrajenski, Alexei

Journal:

Year:

2019

File:

PDF, 5.60 MB

2019

45

Boron nitride for enhanced oxidative dehydrogenation of ethylbenzene

Han, Rui, Diao, Jiangyong, Kumar, Sonu, Lyalin, Andrey, Taketsugu, Tetsuya, Casillas, Gilberto, Richardson, Christopher, Liu, Feng, Yoon, Chang Won, Liu, Hongyang, Sun, Xudong, Huang, Zhenguo

Journal:

Journal of Energy Chemistry

Year:

2020

File:

PDF, 1.28 MB

2020

46

Correction to âCO 2 Adsorption on Ti 3 O 6â : A Novel Carbonate Binding Motifâ

Debnath, Sreekanta, Song, Xiaowei, Fagiani, Matias R., Weichman, Marissa L., Gao, Min, Maeda, Satoshi, Taketsugu, Tetsuya, SchÃ¶llkopf, Wieland, Lyalin, Andrey, Neumark, Daniel M., Asmis, Knut R.

Journal:

The Journal of Physical Chemistry C

Year:

2020

File:

PDF, 881 KB

2020