Boukhvalov, D.: search on Z-Library

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1

Hydrogen on graphene: Electronic structure, total energy, structural distortions and magnetism from first-principles calculations

Boukhvalov, D., Katsnelson, M., Lichtenstein, A.

Journal:

Physical Review B

Year:

2008

Language:

english

File:

PDF, 218 KB

english, 2008

2

Control of Graphene's Properties by Reversible Hydrogenation: Evidence for Graphane

Elias, D. C., Nair, R. R., Mohiuddin, T. M. G., Morozov, S. V., Blake, P., Halsall, M. P., Ferrari, A. C., Boukhvalov, D. W., Katsnelson, M. I., Geim, A. K.

Journal:

Year:

2009

Language:

english

File:

PDF, 296 KB

english, 2009

3

Polystyrene-halloysite nano tube membranes for water purification

Buruga, Kezia, Kalathi, Jagannathan T., Kim, Ki-Hyun, Ok, Yong Sik, Danil, Boukhvalov

Journal:

Journal of Industrial & Engineering Chemistry

Year:

2017

Language:

english

File:

PDF, 1.37 MB

english, 2017

4

Carbon Mono and Dioxide Hydrogenation over Pure and Metal Oxide Decorated Graphene Oxide Substrates: Insight from DFT

W. Boukhvalov, Danil

Journal:

Year:

2013

Language:

english

File:

PDF, 407 KB

english, 2013

5

-Iron

Boukhvalov, D. W., Gornostyrev, Yu. N., Katsnelson, M. I., Lichtenstein, A. I.

Journal:

Physical Review Letters

Year:

2007

Language:

english

File:

PDF, 296 KB

english, 2007

6

Origin of Anomalous Water Permeation through Graphene Oxide Membrane

Boukhvalov, Danil W., Katsnelson, Mikhail I., Son, Young-Woo

Journal:

Year:

2013

Language:

english

File:

PDF, 1.38 MB

english, 2013

7

The atomic and electronic structure of nitrogen- and boron-doped phosphorene

Boukhvalov, Danil W.

Journal:

Physical Chemistry Chemical Physics

Year:

2015

Language:

english

File:

PDF, 3.51 MB

english, 2015

8

Toward the Effective Exploitation of Topological Phases of Matter in Catalysis: Chemical Reactions at the Surfaces of NbAs and TaAs Weyl Semimetals

Politano, Antonio, Chiarello, Gennaro, Li, Zhilin, Fabio, Vito, Wang, Lin, Guo, Liwei, Chen, Xiaolong, Boukhvalov, Danil W.

Journal:

Advanced Functional Materials

Year:

2018

Language:

english

File:

PDF, 2.66 MB

english, 2018

9

Transition-Metal Dichalcogenide NiTe 2 : An Ambient-Stable Material for Catalysis and Nanoelectronics

Nappini, Silvia, Boukhvalov, Danil W., D'Olimpio, Gianluca, Zhang, Libo, Ghosh, Barun, Kuo, Chia-Nung, Zhu, Haoshan, Cheng, Jia, Nardone, Michele, Ottaviano, Luca, Mondal, Debashis, Edla, Raju, Fuji,

Journal:

Advanced Functional Materials

Year:

2020

Language:

english

File:

PDF, 3.19 MB

english, 2020

10

Co and Al co-doping for ferromagnetism in ZnO:Co diluted magnetic semiconductors

Chang, G S, Kurmaev, E Z, Boukhvalov, D W, Finkelstein, L D, Moewes, A, Bieber, H, Colis, S, Dinia, A

Journal:

Journal of Physics Condensed Matter

Year:

2009

Language:

english

File:

PDF, 607 KB

english, 2009

11

The Advent of Indium Selenide: Synthesis, Electronic Properties, Ambient Stability and Applications

Boukhvalov, Danil, Gürbulak, Bekir, Duman, Songül, Wang, Lin, Politano, Antonio, Caputi, Lorenzo, Chiarello, Gennaro, Cupolillo, Anna

Journal:

Year:

2017

Language:

english

File:

PDF, 4.63 MB

english, 2017

12

Liquid-Phase Exfoliated Indium-Selenide Flakes and Their Application in Hydrogen Evolution Reaction

Petroni, Elisa, Lago, Emanuele, Bellani, Sebastiano, Boukhvalov, Danil W., Politano, Antonio, Gürbulak, Bekir, Duman, Songül, Prato, Mirko, Gentiluomo, Silvia, Oropesa-Nuñez, Reinier, Panda, Jaya-Kuma

Journal:

Year:

2018

Language:

english

File:

PDF, 1.55 MB

english, 2018

13

Element-specific electronic structure of Mn dopants and ferromagnetism of (Zn,Mn)O thin films

J. Jin, G.S. Chang, D.W. Boukhvalov, X.Y. Zhang, L.D. Finkelstein, W. Xu, Y.X. Zhou, E.Z. Kurmaev, A. Moewes

Journal:

Thin Solid Films

Year:

2010

Language:

english

File:

PDF, 461 KB

english, 2010

14

Atomic, electronic and magnetic structure of graphene/iron and nickel interfaces: theory and experiment

Boukhvalov, D. W., Gornostyrev, Y. N., Uimin, M. A., Korolev, A. V., Yermakov, A. Y.

Journal:

Year:

2015

Language:

english

File:

PDF, 1.57 MB

english, 2015

15

X-ray photoelectron spectra and electronic structure of Mo doped V2O5

Boukhvalov, D.W., Zhidkov, I.S., Kukharenko, A.I., Cholakh, S.O., Jain, R.K., Khanna, A., Kurmaev, E.Z.

Journal:

Thin Solid Films

Year:

2020

File:

PDF, 905 KB

2020

16

A Computational Investigation of the Catalytic Properties of Graphene Oxide: Exploring Mechanisms by using DFT Methods

Prof. Dr. Danil W. Boukhvalov, Daniel R. Dreyer, Prof. Dr. Christopher W. Bielawski, Prof. Dr. Young-Woo Son

Journal:

Year:

2012

Language:

english

File:

PDF, 1.65 MB

english, 2012

17

Effect of doping and annealing on the electronic structure and magnetic properties of nanoscale Co and Zn co-doped SnO2: An experimental study and first-principles modeling

Boukhvalov, D.W., Manikandan, Dhamodaran, Zhidkov, I.S., Kukharenko, A.I., Cholakh, S.O., Kurmaev, E.Z., Murugan, Ramaswamy

Journal:

Journal of Alloys and Compounds

Year:

2019

Language:

english

File:

PDF, 1.67 MB

english, 2019

18

Defects of the crystal structure and Jahn-Teller distortion in

Boukhvalov, D. W., Solovyev, I. V.

Journal:

Physical Review B

Year:

2010

Language:

english

File:

PDF, 462 KB

english, 2010

19

Reduction of conductivity and ferromagnetism induced by Ag doping in ZnO:Co

Bieber, H., Colis, S., Schmerber, G., Pierron-Bohnes, V., Boukhvalov, D.W., Kurmaev, E.Z., Finkelstein, L.D., Bazylewski, P., Moewes, A., Chang, G.S., Dinia, A.

Journal:

Thin Solid Films

Year:

2013

Language:

english

File:

PDF, 539 KB

english, 2013

20

Valence band resonant photoemission of Mn12 single molecules grafted on Au(1 1 1) surface

U. del Pennino, V. De Renzi, R. Biagi, V. Corradini, L. Zobbi, A. Cornia, D. Gatteschi, F. Bondino, E. Magnano, M. Zangrando, M. Zacchigna, A. Lichtenstein, D.W. Boukhvalov

Journal:

Surface Science

Year:

2006

Language:

english

File:

PDF, 244 KB

english, 2006

21

Hydrogen Dissociation Catalyzed by Carbon-Coated Nickel Nanoparticles: Experiment and Theory

Yermakov, Anatoliy Ye., Boukhvalov, Danil W., Uimin, Michael A., Lokteva, Ekaterina S., Erokhin, Alexey V., Schegoleva, Nina N.

Journal:

Year:

2013

Language:

english

File:

PDF, 731 KB

english, 2013

22

Effect of Co and O defects on the magnetism in Co-doped ZnO: Experiment and theory

Chang, G. S., Kurmaev, E. Z., Boukhvalov, D. W., Finkelstein, L. D., Colis, S., Pedersen, T. M., Moewes, A., Dinia, A.

Journal:

Physical Review B

Year:

2007

Language:

english

File:

PDF, 210 KB

english, 2007

23

magnetic molecules

Boukhvalov, D. W., Lichtenstein, A. I., Dobrovitski, V. V., Katsnelson, M. I., Harmon, B. N., Mazurenko, V. V., Anisimov, V. I.

Journal:

Physical Review B

Year:

2002

Language:

english

File:

PDF, 151 KB

english, 2002

24

Evidence of inter-species swing adsorption between aromatic hydrocarbons

Vikrant, Kumar, Kim, Ki-Hyun, Szulejko, Jan E., Boukhvalov, Danil, Shang, Jin, Rinklebe, Jörg

Journal:

Environmental Research

Year:

2019

File:

PDF, 4.01 MB

2019

25

Stable antiferromagnetic graphone

D.W. Boukhvalov

Journal:

Physica E: Low-dimensional Systems and Nanostructures

Year:

2010

Language:

english

File:

PDF, 541 KB

english, 2010

26

New single-molecule magnet based on Mn12 oxocarboxylate clusters with mixed carboxylate ligands, [Mn12O12(CN-o-C6H4CO2)12(CH3CO2)4(H2O)4]·8CH2Cl2: Synthesis, crystal and electronic structure, magnetic properties

Kushch, L. A., Sasnovskaya, V. D., Dmitriev, A. I., Yagubskii, E. B., Koplak, O. V., Zorina, L. V., Boukhvalov, D. W.

Journal:

Dalton Transactions

Year:

2012

Language:

english

File:

PDF, 1.15 MB

english, 2012

27

First-Principles Modeling of the Polycyclic Aromatic Hydrocarbons Reduction

Boukhvalov, D. W., Feng, X., Müllen, K.

Journal:

The Journal of Physical Chemistry C

Year:

2011

Language:

english

File:

PDF, 3.53 MB

english, 2011

28

Modeling of hydrogen and hydroxyl group migration on graphene

Boukhvalov, D. W.

Journal:

Physical Chemistry Chemical Physics

Year:

2010

Language:

english

File:

PDF, 1.27 MB

english, 2010

29

Charge transfer and weak bonding between molecular oxygen and graphene zigzag edges at low temperatures

Boukhvalov, D.W., Osipov, V.Yu., Shames, A.I., Takai, K., Hayashi, T., Enoki, T.

Journal:

Year:

2016

Language:

english

File:

PDF, 2.28 MB

english, 2016

30

A self-healing elastomer based on an intrinsic non-covalent cross-linking mechanism

Chen, Jun, Li, Fanzhu, Luo, Yanlong, Ma, Xiaofeng, Shi, Yijun, Zhang, Meng, Danil W, Boukhvalov, Luo, Zhenyang

Journal:

Journal of Materials Chemistry A

Year:

2019

Language:

english

File:

PDF, 1.12 MB

english, 2019

31

Charge Redistribution Mechanisms in SnSe 2 Surfaces Exposed to Oxidative and Humid Environments and Their Related Influence on Chemical Sensing

DâOlimpio, Gianluca, Genuzio, Francesca, MenteÅ, Tevfik Onur, Paolucci, Valentina, Kuo, Chia-Nung, Al Taleb, Amjad, Lue, Chin Shan, Torelli, Piero, FarÃas, Daniel, Locatelli, Andrea, Boukhvalov, D

Journal:

The Journal of Physical Chemistry Letters

Year:

2020

File:

PDF, 2.19 MB

2020

32

Direct Experimental Evidence of Metal-Mediated Etching of Suspended Graphene

Ramasse, Quentin M., Zan, Recep, Bangert, Ursel, Boukhvalov, Danil W., Son, Young-Woo, Novoselov, Konstantin S.

Journal:

Year:

2012

Language:

english

File:

PDF, 3.78 MB

english, 2012

33

Electronic structure and photoluminescence properties of Zn-ion implanted silica glass before and after thermal annealing

Zatsepin, D.A., Zatsepin, A.F., Boukhvalov, D.W., Kurmaev, E.Z., Pchelkina, Z.V., Gavrilov, N.V.

Journal:

Journal of Non-Crystalline Solids

Year:

2016

Language:

english

File:

PDF, 1.15 MB

english, 2016

34

Unveiling the Mechanisms Leading to H2 Production Promoted by Water Decomposition on Epitaxial Graphene at Room Temperature

Politano, Antonio, Cattelan, Mattia, Boukhvalov, Danil W., Campi, Davide, Cupolillo, Anna, Agnoli, Stefano, Apostol, Nicoleta G., Lacovig, Paolo, Lizzit, Silvano, Farias, Daniel, Chiarello, Gennaro, G

Journal:

Year:

2016

Language:

english

File:

PDF, 1.09 MB

english, 2016

35

Development of theoretical descriptors for evaluation of cytotoxicity of metallic nanoparticles

Boukhvalov, Danil W., Yoon, Tae Hyun

Journal:

Chemical Research in Toxicology

Year:

2017

Language:

english

File:

PDF, 1.55 MB

english, 2017

36

The utilization of zinc recovered from alkaline battery waste as metal precursor in the synthesis of metal-organic framework

Vellingiri, Kowsalya, Tsang, Daniel C.W., Kim, Ki-Hyun, Deep, Akash, Dutta, Tanushree, Boukhvalov, Danil W.

Journal:

Journal of Cleaner Production

Year:

2018

Language:

english

File:

PDF, 3.34 MB

english, 2018

37

Effect of long-term storage on the electronic structure of semiconducting silicon wafers implanted by rhenium ions

Zatsepin, D. A., Boukhvalov, D. W., Zatsepin, A. F., Mikhaylov, A. N., Gerasimenko, N. N., Zaporozhan, O. A.

Journal:

Journal of Materials Science

Year:

2020

File:

PDF, 1.33 MB

2020

38

Covalent Functionalization of Strained Graphene

Prof. Dr. Danil W. Boukhvalov, Prof. Dr. Young-Woo Son

Journal:

Year:

2012

Language:

english

File:

PDF, 2.36 MB

english, 2012

39

The influence of chemical reactivity of surface defects on ambient-stable InSe-based nanodevices

Politano, Antonio, Chiarello, Gennaro, Samnakay, Rameez, Liu, Guanxiong, Gurbulak, Bekir, Duman, Songul, Balandin, A., Boukhvalov, Danil

Journal:

Year:

2016

Language:

english

File:

PDF, 1.24 MB

english, 2016

40

Influence of dopants on the impermeability of graphene

Mallineni, S. S. K., Boukhvalov, D. W., Zhidkov, I. S., Kukharenko, A. I., Slesarev, A. I., Zatsepin, A. F., Cholakh, S. O., Rao, A. M., Serkiz, S. M., Bhattacharya, S., Kurmaev, E. Z., Podila, R.

Journal:

Year:

2017

Language:

english

File:

PDF, 1.73 MB

english, 2017

41

Enhanced clustering tendency of Cu-impurities with a number of oxygen vacancies in heavy carbon-loaded TiO 2 - the bulk and surface morphologies

Zatsepin, D.A., Boukhvalov, D.W., Kurmaev, E.Z., Zatsepin, A.F., Kim, S.S., Gavrilov, N.V., Zhidkov, I.S.

Journal:

Solid State Sciences

Year:

2017

Language:

english

File:

PDF, 1.51 MB

english, 2017

42

Development of highly water stable graphene oxide based composites for the removal of pharmaceuticals and personal care products

Delhiraja, Krithika, Vellingiri, Kowsalya, Boukhvalov, Danil W., Philip, Ligy

Journal:

Industrial & Engineering Chemistry Research

Year:

2019

File:

PDF, 1013 KB

2019

43

Electronic structure and structural defects in 3d-metal doped In2O3

Ho, J., Becker, J., Leedahl, B., Boukhvalov, D. W., Zhidkov, I. S., Kukharenko, A. I., Kurmaev, E. Z., Cholakh, S. O., Gavrilov, N. V., Brinzari, V. I., Moewes, A.

Journal:

Journal of Materials Science: Materials in Electronics

Year:

2019

Language:

english

File:

PDF, 2.33 MB

english, 2019

44

Catalytic activity of PtSn4: Insights from surface-science spectroscopies

D'Olimpio, Gianluca, Boukhvalov, Danil W., Fujii, Jun, Torelli, Piero, Marchionni, Andrea, Filippi, Jonathan, Kuo, Chia-Nung, Edla, Raju, Ottaviano, Luca, Lue, Chin Shan, Vizza, Francesco, Nappini, Si

Journal:

Applied Surface Science

Year:

2020

File:

PDF, 2.30 MB

2020

45

Chemical instability of free-standing boron monolayers and properties of oxidized borophene sheets

Lei, Xue, Zatsepin, Anatoly F., Boukhvalov, Danil W.

Journal:

Physica E: Low-dimensional Systems and Nanostructures

Year:

2020

Language:

english

File:

PDF, 936 KB

english, 2020

46

Self-Assembled SnO 2 /SnSe 2 Heterostructures: A Suitable Platform for Ultrasensitive NO 2 and H 2 Sensing

Paolucci, Valentina, DâOlimpio, Gianluca, Kuo, Chia-Nung, Lue, Chin Shan, Boukhvalov, Danil W., Cantalini, Carlo, Politano, Antonio

Journal:

ACS Applied Materials & Interfaces

Year:

2020

File:

PDF, 2.15 MB

2020

47

X-ray absorption and emission spectroscopic investigation of Mn doped ZnO films

J. Jin, G.S. Chang, Y.X. Zhou, X.Y. Zhang, D.W. Boukhvalov, E.Z. Kurmaev, A. Moewes

Journal:

Applied Surface Science

Year:

2011

Language:

english

File:

PDF, 604 KB

english, 2011

48

Tuning the gap in bilayer graphene using chemical functionalization: Density functional calculations

Boukhvalov, D. W., Katsnelson, M. I.

Journal:

Physical Review B

Year:

2008

Language:

english

File:

PDF, 406 KB

english, 2008

49

molecular magnet

Boukhvalov, D. W., Vergara, L. I., Dobrovitski, V. V., Katsnelson, M. I., Lichtenstein, A. I., Kögerler, P., Musfeldt, J. L., Harmon, B. N.

Journal:

Physical Review B

Year:

2008

Language:

english

File:

PDF, 174 KB

english, 2008

50

Structural defects and electronic structure of N-ion implanted TiO2: Bulk versus thin film

Zatsepin, D.A., Boukhvalov, D.W., Kurmaev, E.Z., Zhidkov, I.S., Gavrilov, N.V., Korotin, M.A., Kim, S.S.

Journal:

Applied Surface Science

Year:

2015

Language:

english

File:

PDF, 512 KB

english, 2015

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