1
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Sadykov V.A.
, Eremeev N.F.
, Sadovskaya E.M.
, Chesalov Y.A.
, Pavlova S.N.
, Rogov V.A.
, Simonov M.N.
, Bobin A.S.
, Glazneva T.S.
, Smal E.A.
, Lukashevich A.I.
, Krasnov A.V.
, Avdeev V.I.
, Roger A-C.
Detailed Mechanism of Ethanol Transformation into Syngas on Catalysts Based on Mesoporous MgAl2O4 Support Loaded with Ru + Ni/(PrCeZrO or MnCr2O4) Active Components
Topics in Catalysis. 2020.
V.63. N1-2. P.166-177. DOI: 10.1007/s11244-020-01222-1
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2
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Avdeev V.I.
, Bedilo A.F.
Formation of Reactive Oxygen by N2O Decomposition over Binuclear Cationic Sites of Fe-Ferrierite Zeolite:
Periodic DFT + U Study
Chemical Physics Letters. 2018.
V.695. P.222-227. DOI: 10.1016/j.cplett.2018.02.011
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3
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Volodin A.M.
, Avdeev V.I.
, Malykhin S.E.
, Bedilo A.F.
EPR and DFT Study of the Ethylene Reaction with O− Radicals on the Surface of Nanocrystalline MgO
Research on Chemical Intermediates. 2017.
V.43. N2. P.1047-1061. DOI: 10.1007/s11164-016-2682-9
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4
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Startsev A.N.
, Kruglyakova O.V.
, Chesalov Y.A.
, Paukshtis E.A.
, Avdeev V.I.
, Ruzankin S.P.
, Zhdanov A.A.
, Molina I.Y.
, Plyasova L.M.
Low-Temperature Catalytic Decomposition of Hydrogen Sulfide on Metal Catalysts Under Layer of Solvent
Journal of Sulfur Chemistry. 2016.
V.37. N2. P.229-240. DOI: 10.1080/17415993.2015.1126593
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5
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Avdeev V.I.
, Bedilo A.F.
Molecular Mechanism of Propane Oxidative Dehydrogenation on Surface Oxygen Radical Sites of VOx/TiO2 Catalysts
Research on Chemical Intermediates. 2016.
V.42. N6. P.5237-5252. DOI: 10.1007/s11164-015-2355-0
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6
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Svintsitskiy D.A.
, Slavinskaya E.M.
, Kardash T.Y.
, Avdeev V.I.
, Senkovskiy B.V.
, Koshcheev S.V.
, Boronin A.I.
Low-Temperature Catalytic CO Oxidation over Mixed Silver–Copper Oxide Ag2Cu2O3
Applied Catalysis A: General. 2016.
V.510. P.64-73. DOI: 10.1016/j.apcata.2015.11.011
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7
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Avdeev V.I.
, Bedilo A.F.
Molecular Mechanism of Oxygen Exchange over Supported Vanadium Oxide Catalyst VOx/TiO2
The Journal of Physical Chemistry C. 2013.
V.117. N6. P.2879-2887. DOI: 10.1021/jp311322b
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8
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Avdeev V.I.
, Bedilo A.F.
Electronic Structure of Oxygen Radicals on the Surface of VOx/TiO2 Catalysts and Their Role in Oxygen Isotopic Exchange
The Journal of Physical Chemistry C. 2013.
V.117. N28. P.14701-14709. DOI: 10.1021/jp404921d
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9
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Snytnikov V.N.
, Mishchenko T.I.
, Snytnikov V.N.
, Malykhin S.E.
, Avdeev V.I.
, Parmon V.N.
Autocatalytic Gas-Phase Dehydrogenation of Ethane
Research on Chemical Intermediates. 2012.
V.38. P.1133-1147. DOI: 10.1007/s11164-011-0449-x
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10
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Avdeev V.I.
, Parmon V.N.
Molecular Mechanism of the Formic Acid Decomposition on V2O5/TiO2 Catalysts: A Periodic DFT Analysis
The Journal of Physical Chemistry C. 2011.
V.115. N44. P.21755-21762. DOI: 10.1021/jp204652n
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11
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Avdeev V.I.
, Tapilin V.M.
Water Effect on the Electronic Structure of Active Sites of Supported Vanadium Oxide Catalyst VOx/TiO2(001)
The Journal of Physical Chemistry C. 2010.
V.114. N8. P.3609-3613. DOI: 10.1021/jp911145c
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12
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Kibis L.S.
, Avdeev V.I.
, Koscheev S.V.
, Boronin A.I.
Oxygen Species on the Silver Surface Oxidized by MW-Discharge. Study by Photoelectron Spectroscopy and DFT Model Valculations
Surface Science. 2010.
V.604. N13-14. P.1185-1192. DOI: 10.1016/j.susc.2010.03.035
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13
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Avdeev V.I.
, Parmon V.N.
Oxidation of Formaldehyde to Formic Acid over V2O5/TiO2 Catalysts: A DFT Analysis of the Molecular Reaction Mechanisms
The Journal of Physical Chemistry C. 2009.
V.113. N7. P.2873-2880. DOI: 10.1021/jp806231e
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14
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Avdeev V.I.
, Tapilin V.M.
Electronic Structure and Stability of Peroxide Divanadate Species V(O-O) on the TiO2(001) Surface Reconstructed
The Journal of Physical Chemistry C. 2009.
V.113. N33. P.14941-14945. DOI: 10.1021/jp904211a
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15
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Авдеев В.И.
, Ковальчук В.И.
, Жидомиров Г.М.
, Д'Итри Д.Л.
Модели активных центров металлических нанесенных Cu-катализаторов в реакции дехлорирования 1,2-дихлорэтана. Теоретический анализ методом DFT
Журнал структурной химии. 2007.
Т.48. №7. С.S169-S179.
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16
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Avdeev V.I.
, Kovalchuk V.I.
, Zhidomirov G.M.
, d’Itri J.L.
Models of Active Sites in Supported Cu Metal Catalysts in 1,2-Dichloroethane Dechlorination. DFT Analysis
Journal of Structural Chemistry. 2007.
V.48. NS7. P.S160-S170. DOI: 10.1007/s10947-007-0159-9
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17
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Авдеев В.И.
, Ковальчук В.И.
, Жидомиров Г.М.
, Д'Итри Д.Л.
Анализ механизма реакции дехлорирования 1,2-дихлорэтана на нанесенных биметаллических Cu—Pt-катализаторах методом
Журнал структурной химии. 2007.
Т.48. №7. С.S180-S192.
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18
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Avdeev V.I.
, Kovalchuk V.I.
, Zhidomirov G.M.
, d’Itri J.L.
DFT Analysis of the Mechanism of 1,2-Dichloroethane Dechlorination on Supported Cu-Pt Bimetallic Catalysts
Journal of Structural Chemistry. 2007.
V.48. NS7. P.S171-S183. DOI: 10.1007/s10947-007-0160-3
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19
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Авдеев В.И.
, Рузанкин С.Ф.
, Жидомиров Г.М.
Молекулярный механизм реакции прямого окисления алкенов закисью азота. Теоретический анализ методом DFT
Кинетика и катализ. 2005.
Т.46. №2. С.191-202.
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20
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Mezentseva N.V.
, Sadykov V.A.
, Avdeev V.I.
, Kuznetsov V.L.
Analysis of the Structural Specificity of ZrO2 Nanoparticles in Pillared Clays by Modeling the Condensation Process in ZrOCl2*8H2O Solutions
In compilation
Combinatorial Methods and Informatics in Materials Science: Volume 894 (MRS Proceedings) 1st Edition.
– Materials Research Society; 1st edition (May 17, 2006).,
2005.
– ISBN 1558998489. DOI: 10.1557/PROC-0894-LL06-05
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