21
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Kolganov A.A.
, Gabrienko A.A.
, Stepanov A.G.
The DFT Approach to Predict 13C NMR Chemical Shifts of Hydrocarbon Species Adsorbed on Zn-Modified Zeolites
PCCP: Physical Chemistry Chemical Physics. 2022.
V.24. P.22241-22249. DOI: 10.1039/d2cp02468c
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22
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Khudozhitkov A.E.
, Stange P.
, Stepanov A.G.
, Kolokolov D.I.
, Ludwig R.
Structure, Hydrogen Bond Dynamics and Phase Transition in a Model Ionic Liquid Electrolyte
PCCP: Physical Chemistry Chemical Physics. 2022.
V.24. P.6064-6071. DOI: 10.1039/d2cp00452f
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РИНЦ
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23
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Khudozhitkov A.E.
, Arzumanov S.S.
, Kolokolov D.I.
, Stepanov A.G.
Butane Isomers Mobility and Framework Dynamics in UiO-66 (Zr) MOF: Impact of the Hydroxyl Groups in Zirconia Cluster
Solid State Nuclear Magnetic Resonance. 2022.
V.118. 101784
:1-7. DOI: 10.1016/j.ssnmr.2022.101784
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24
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Kolganov A.A.
, Gabrienko A.A.
, Chernyshov I.Y.
, Stepanov A.G.
, Pidko E.A.
Property–Activity Relations of Multifunctional Reactive Ensembles in Cation-Exchanged Zeolites: A Case Study of Methane Activation on Zn2+-Modified Zeolite BEA
PCCP: Physical Chemistry Chemical Physics. 2022.
V.24. N11. P.6492-6504. DOI: 10.1039/d1cp05854a
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РИНЦ
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25
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Gabrienko A.A.
, Arzumanov S.S.
, Toktarev A.V.
, Prosvirin I.P.
, Freude D.
, Haase J.
, Stepanov A.G.
Propane Transformation on In-Modified Zeolite BEA
The Journal of Physical Chemistry C. 2022.
V.126. N38. P.16204-16214. DOI: 10.1021/acs.jpcc.2c05888
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26
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Arzumanov S.S.
, Gabrienko A.A.
, Toktarev A.V.
, Freude D.
, Haase J.
, Stepanov A.G.
H/D Exchange of Propane on Indium-Modified Zeolite BEA Investigated by 1H MAS NMR In Situ
The Journal of Physical Chemistry C. 2022.
V.126. N46. P.19766–19775. DOI: 10.1021/acs.jpcc.2c06618
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РИНЦ
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27
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Khudozhitkov A.E.
, Stange P.
, Paschek D.
, Stepanov A.G.
, Kolokolov D.I.
, Ludwig R.
The Influence of Deuterium Isotope Effects on Structural Rearrangements, Ensemble Equilibria, and Hydrogen Bonding in Protic Ionic Liquids
ChemPhysChem. 2022.
V.23. N23. e202200557
:1-6. DOI: 10.1002/cphc.202200557, 10.1002/cphc.202200828, 10.1002/cphc.202200827
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РИНЦ
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28
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Khudozhitkov A.E.
, Donoshita M.
, Stepanov A.G.
, Philippi F.
, Rauber D.
, Hempelmann R.
, Kitagawa H.
, Kolokolov D.I.
, Ludwig R.
Cover Feature: High-Temperature Quantum Tunneling and Hydrogen Bonding Rearrangements Characterize the Solid-Solid Phase Transitions in a Phosphonium-Based Protic Ionic Liquid
Chemistry - A European Journal. 2022.
V.28. N23. e202200963
:1-1. DOI: 10.1002/chem.202200963
РИНЦ
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29
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Gabrienko A.A.
, Lashchinskaya Z.N.
, Arzumanov S.S.
, Toktarev A.V.
, Freude D.
, Haase J.
, Stepanov A.G.
Isobutane Transformation to Aromatics on Zn‐Modified Zeolites. The Intermediates and the Effect of Zn2+ and ZnO Species on the Reaction Occurrence Revealed with 13C MAS NMR
ChemPhysChem. 2022.
V.23. N1. e2021005
:1-9. DOI: 10.1002/cphc.202100587
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РИНЦ
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30
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Trenholme W.J.F.
, Kolokolov D.I.
, Bound M.
, Argent S.P.
, Gould J.A.
, Li J.
, Barnett S.A.
, Blake A.J.
, Stepanov A.G.
, Besley E.
, Easun T.L.
, Yang S.
, Schröder M.
Selective Gas Uptake and Rotational Dynamics in a (3,24)-Connected Metal–Organic Framework Material
Journal of the American Chemical Society. 2021.
V.143. N9. P.3348-3358. DOI: 10.1021/jacs.0c11202
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РИНЦ
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31
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Gabrienko A.A.
, Lashchinskaya Z.N.
, Arzumanov S.S.
, Toktarev A.V.
, Freude D.
, Haase J.
, Stepanov A.G.
Isobutene Transformation to Aromatics on Zn-Modified Zeolite: Particular Effects of Zn2+ and ZnO Species on the Reaction Occurrence Revealed with Solid-State NMR and FTIR Spectroscopy
The Journal of Physical Chemistry C. 2021.
V.125. N28. P.15343–15353. DOI: 10.1021/acs.jpcc.1c04249
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РИНЦ
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32
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Khudozhitkov A.E.
, Arzumanov S.S.
, Kolokolov D.I.
, Stepanov A.G.
UiO-66 (Zr) MOF as a Promising Material for Butane Isomers Separation: Evidence Based on the Analysis of the Adsorbed Alkanes Mobility by 2H NMR and Molecular Dynamics Simulation
The Journal of Physical Chemistry C. 2021.
V.125. N24. P.13391–13400. DOI: 10.1021/acs.jpcc.1c02849
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РИНЦ
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33
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Khudozhitkov A.E.
, Arzumanov S.S.
, Toktarev A.V.
, Cherepanova S.V.
, Gabrienko A.A.
, Kolokolov D.I.
, Stepanov A.G.
Dissecting the Effects of Water Guest Adsorption and Framework Breathing on the AlO4(OH)2 Centres of Metal–Organic Framework MIL-53 (Al) by Solid State NMR and Structural Analysis
PCCP: Physical Chemistry Chemical Physics. 2021.
V.23. N34. P.18925-18929. DOI: 10.1039/d1cp03060d
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РИНЦ
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34
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Gabrienko A.A.
, Lashchinskaya Z.N.
, Arzumanov S.S.
, Toktarev A.V.
, Freude D.
, Haase J.
, Stepanov A.G.
1H MAS NMR In Situ Reaction Monitoring Reveals the Particular Effects of Zn2+ and ZnO Species on the Kinetics of Isobutane Transformation on Zn-Modified Zeolites
The Journal of Physical Chemistry C. 2021.
V.125. N39. P.21471–21480. DOI: 10.1021/acs.jpcc.1c07080
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35
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Stepanov A.G.
, Arzumanov S.S.
, Gabrienko A.A.
Unraveling the Mechanism of Methane Activation on Zn‐Modified Zeolites by Solid‐State NMR
Chemistry-Methods. 2021.
V.1. N5. P.224-230. DOI: 10.1002/cmtd.202100021
РИНЦ
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36
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Khudozhitkov A.E.
, Zhao H.
, Ghoufi A.
, Arzumanov S.S.
, Kolokolov D.I.
, Maurin G.
, Stepanov A.G.
Molecular Insight into the Slow Dynamics of C4 Hydrocarbons in the Zeolitic–Imidazole Framework (ZIF-8)
ACS Applied Materials and Interfaces. 2021.
V.13. N28. P.33685–33692. DOI: 10.1021/acsami.1c08529
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РИНЦ
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37
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Kolokolov D.I.
, Freude D.
, Stepanov A.G.
Dynamics in Nanoporous Materials Probed by 2H Solid State NMR: Estimation of Self-Diffusion Coefficients
Adsorption. 2021.
V.27. N5. P.841-855. DOI: 10.1007/s10450-020-00256-x
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РИНЦ
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38
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Gabrienko A.A.
, Kolganov A.A.
, Arzumanov S.S.
, Yashnik S.A.
, Kriventsov V.V.
, Freude D.
, Stepanov A.G.
Effect of Copper State in Cu/H-ZSM-5 on Methane Activation by Brønsted Acid Sites, Studied by 1H MAS NMR In Situ Monitoring the H/D Hydrogen Exchange of the Alkane with Brønsted Acid Sites
The Journal of Physical Chemistry C. 2021.
V.125. N3. P.2182–2193. DOI: 10.1021/acs.jpcc.0c10261
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39
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Arzumanov S.S.
, Gabrienko A.A.
, Toktarev A.V.
, Freude D.
, Haase J.
, Stepanov A.G.
Mechanism of H/D Hydrogen Exchange of n-Butane with Brønsted Acid Sites on Zn-Modified Zeolite: The Effect of Different Zn Species (Zn2+ and ZnO) on the Activation of Alkane C–H Bonds
The Journal of Physical Chemistry C. 2020.
V.124. N37. P.20270-20279. DOI: 10.1021/acs.jpcc.0c06616
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40
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Kolganov A.A.
, Gabrienko A.A.
, Chernyshov I.Y.
, Stepanov A.G.
, Pidko E.A.
The Accuracy Challenge of the DFT-Based Molecular Assignment of 13C MAS NMR Characterization of Surface Intermediates in Zeolite Catalysis
PCCP: Physical Chemistry Chemical Physics. 2020.
V.22. N41. P.24004-24013. DOI: 10.1039/d0cp04439c
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