Articles - Sciact

Articles (81)

#	Публикация
1	Shubin A.A. , Kovalskii V.Y. , Ruzankin S.P. , Zilberberg I.L. , Parmon V.N. , Tomilin F.N. , Avramov P.V. The FeIV-O• Oxyl Unit as a Key Intermediate in Water Oxidation on the FeIII-Hydroxide: DFT Predictions International Journal of Quantum Chemistry. 2021. DOI: 10.1002/qua.26610 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type
2	Shubin A.A. , Kovalskii V.Y. , Ruzankin S.P. , Zilberberg I.L. , Parmon V.N. Water Oxidation versus Hydroxylation by the Terminal Oxo Center of the Fe(III)-Hydroxide: DFT Predictions arXiv.org, e-Print Archive, Physics. 2018. arxiv:1810.06343 :1-11.
3	Kovalskii V. , Shubin A.A. , Chen Y. , Ovchinnikov D. , Ruzankin S.P. , Hasegawa J. , Zilberberg I. , Parmon V.N. Hidden Radical Reactivity of the [FeO]2+ Group of the (Hydro)oxide Species in the H-Abstraction from Methane: A DFT and CASPT2 Study arXiv.org, e-Print Archive, Physics. 2017. P.1-40.
4	Kovalskii V. , Shubin A. , Chen Y. , Ovchinnikov D. , Ruzankin S.P. , Hasegawa J. , Zilberberg I. , Parmon V.N. Hidden Radical Reactivity of the [FeO]2+ Group in the H-Abstraction from Methane: DFT and CASPT2 Supported Mechanism by the Example of Model Iron (Hydro)oxide Species Chemical Physics Letters. 2017. V.679. P.193-199. DOI: 10.1016/j.cplett.2017.05.002 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
5	Рузанкин С.Ф. , Шубин А.А. , Ковальский В.Ю. , Зильберберг И.Л. Анализ спин-поляризованных решений в базисе парных орбиталей Журнал структурной химии. 2016. Т.57. №5. С.1047-1065. DOI: 10.15372/JSC20160521 publication_identifier_short.rsci_identifier_type publication_identifier_short.rinz_identifier_type
6	Ruzankin S.P. , Shubin A.A. , Kovalʹskii V.Y. , Zil'berberg I.L. Analysis of Spin-Polarized Solutions in the Basis Set of Paired Orbitals Journal of Structural Chemistry. 2016. V.57. N5. P.997-1014. DOI: 10.1134/S0022476616050218 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
7	Zilberberg I.L. , Shubin A.A. , Ruzankin S.P. , Kovalskii V.Y. , Ovchinnikov D.A. , Parmon V.N. DFT Predictions for Hydrogen Atom Transfer at the [FeO]2+ Group: A Distinct Activity of the Oxyl State FeIII-O• In compilation Proceedings of the International Conference of Computational Methods in Sciences and Engineering 2016 (ICCMSE-2016). 2016. – ISBN 978-0-7354-1454-9. DOI: 10.1063/1.4968653 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
8	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 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
9	Shubin A.A. , Ruzankin S.P. , Zilberberg I.L. , Taran O.P. , Parmon V.N. The Routes of Association of (Hydro)oxo centers on Iron Hydroxide at the Water Oxidation Process: DFT Predictions Chemical Physics Letters. 2015. V.619. P.126-132. DOI: 10.1016/j.cplett.2014.11.061 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
10	Shubin A.A. , Ruzankin S.P. , Zilberberg I.L. , Parmon V.N. Distinct Activity of the Oxyl Fe(III) -O Group in the Methane Dissociation by Activated Iron Hydroxide: DFT Predictions Chemical Physics Letters. 2015. V.640. P.94-100. DOI: 10.1016/j.cplett.2015.10.016 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
11	Startsev A.N. , Bulgakov N.N. , Ruzankin S.P. , Kruglyakova O.V. , Paukshtis E.A. The Reaction Thermodynamics of Hydrogen Sulfide Decomposition into Hydrogen and Diatomic Sulfur Journal of Sulfur Chemistry. 2015. V.36. N3. P.234-239. DOI: 10.1080/17415993.2015.1010533 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
12	Старцев А.Н. , Круглякова О.В. , Рузанкин С.Ф. , Булгаков Н.Н. , Чесалов Ю.А. , Кравцов Е.А. , Жейвот В.И. , Ларина Т.В. , Паукштис Е.А. Особенности низкотемпературного каталитического разложения сероводорода Журнал физической химии. 2014. Т.88. №6. С.943-956. DOI: 10.7868/S004445371406034X publication_identifier_short.rinz_identifier_type
13	Startsev A.N. , Kruglyakova O.V. , Chesalov Y.A. , Ruzankin S.P. , Kravtsov E.A. , Larina T.V. , Paukshtis E.A. Low Temperature Catalytic Decomposition of Hydrogen Sulfide into Hydrogen and Diatomic Gaseous Sulfur Topics in Catalysis. 2013. V.56. N11. P.969-980. DOI: 10.1007/s11244-013-0061-y publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
14	Ruzankin S.P. , Lyskov I. , Zilberberg I.L. Net Spin and Polarization Components of the Spin Density for the Single Determinant in the Basis of Paired Orbitals International Journal of Quantum Chemistry. 2012. V.112. N18. P.3052-3058. DOI: 10.1002/qua.24228 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
15	Афанасьев Д.С. , Ануфриенко В.Ф. , Рузанкин С.Ф. , Ларина Т.В. , Кузнецова Н.И. , Бухтияров В.И. Влияние адсорбиции кислорода на поверхностный плазмонный резонанс наночастиц серебра, стабилизированных на оксидных носителях Доклады Академии наук. 2011. Т.436. №5. С.644-646. publication_identifier_short.rinz_identifier_type
16	Afanasʹev D.S. , Anufrienko V.F. , Ruzankin S.F. , Larina T.V. , Kuznetsova N.I. , Bukhtiyarov V.I. Effect of Oxygen Adsorption on the Surface Plasmon Resonance of Oxide-Supported Silver Nanoparticles Doklady Physical Chemistry. 2011. V.436. N2. P.23-25. DOI: 10.1134/S0012501611020035 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
17	Zilberberg I. , Ruzankin S. Paired Orbitals for Different Spins Equations Journal of Computational Chemistry. 2010. V.31. N1. P.84-89. DOI: 10.1002/jcc.21294 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
18	Zilberberg I. , Ruzankin S.P. Spin-Polarized Self-Consistent-Field Equations for Paired Orbitals Physical Review A - Atomic, Molecular and Optical Physics. 2010. V.82. N4. P.042505. DOI: 10.1103/PhysRevA.82.042505 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
19	Yashnik S.A. , Anufrienko V.F. , Zaikovskii V.I. , Rogov V.A. , Ruzankin S.P. , Ismagilov Z.R. Stabilization of Copper Nanoparticles in Cu-ZSM-5 In compilation Zeolites and related materials: Trends, targets and challenges: Proceedings of the 4th International FEZA Conference, 2-6 September 2008, Paris, France. 2008. – Т.Part A. – C.177-180. – ISBN 9780444532985. DOI: 10.1016/S0167-2991(08)80171-1 publication_identifier_short.wos_identifier_type publication_identifier_short.scopus_identifier_type publication_identifier_short.rinz_identifier_type
20	Zilberberg I. , Ruzankin S.P. Paired Orbitals for Different Spins Equations arXiv.org, e-Print Archive, Physics. 2008. NarXiv:0804.0967v1 [physics.chem-ph]. P.1-11.

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