from first principles PP-I-1

Section of the young scientistsOY-I-1 Ratmanova N.K., Mukhamedzyanova D.F., Pichugina D.A., Kuz’menko N.E.The Theoretical Prediction of Structural and Electronic Effectsof Gold-Based Systems in Selective Alkynes Activation .............................................................................. 87OY-II-1 Bocharova V.V., Kraikivskii P.B., Saraev V.V.The Role of Monovalent Nickel in Metalcomplex Catalysis ........................................................................ 88OY-II-2 Lyakin O.Y., Ottenbacher R.V., Bryliakov K.P., Talsi E.P.Non-Heme Iron and Manganese-Catalyzed Asymmetric Olefin Epoxidations with H 2 O 2 :Probing the Nature of Active Species by EPR Spectroscopic and Enantioselectivity Studies .................. 89OY-II-3 Ottenbacher R.V., Talsi E.P., Bryliakov K.P.Highly Efficient, Regioselective and Stereospecific Oxidation of Non-Activated AliphaticC-H Groups with H 2 O 2 , Catalyzed by Aminopyridine Manganese Complexes ........................................ 90OY-II-4 Ivancheva N.I., Sanieva D.V., Molev O.V., Fedorov S.P., Oleinik I.V., Ivanchev S.S.Self-Immobilizing Catalysts for Ethylene Polymerization Based on Derivativesof bis(Phenoxy-Imine) Titanium Halide Complexes .................................................................................... 91OY-II-5 Tarkhanova I.G., Gantman M.G., Zelikman V.M.Radical Processes Catalysed by Transition Metal Complexes with Grafted Ionic Liquids ...................... 92OY-II-6 Kozhevnikov I.V., Chibiryaev A.M., Nuzhdin A.L., Bukhtiyarova G.A., Martyanov O.N.Catalytic Effect of Si-Containing Compounds on the C-Methylation of Indole in sc-MeOH .................. 93OY-III-1 Gabrienko A.A., Arzumanov S.S., Stepanov A.G.Methane Activation and Conversion on Ag/H-MFI Catalyst ...................................................................... 94OY-III-2 Meemken F., Maeda N., Hungerbühler K., Baiker A.Platinum-Catalyzed Asymmetric Hydrogenation: Spectroscopic Evidencefor O-H-O Hydrogen Bond Interaction between Substrate and Modifier ................................................. 95OY-III-3 Kavalerskaya N.E., Rostovchshikova T.N., Lokteva E.S., Golubina E.V., Maslakov K.I.Unusually Active Nanostructured Ni Catalysts with Low Metal Coverage for ChlorobenzeneHydrodechlorination ....................................................................................................................................... 96OY-III-4 Kazantsev M.S., Luzgin M.V., Volkova G.G., Stepanov A.G.Carbonylation of Dimethyl Ether on Rh/Cs 2 HPW 12 O 40 : Mechanism of theReaction in the Presence of Methyl Iodide Promoter .................................................................................. 97OY-III-5 Khudorozhkov A.K., Prosvirin I.P., Bukhtiyarov V.I.Studying the Influence of Precursor and Promoter to the Activity and Stabilityof Methane Combustion Catalysts ................................................................................................................. 98OY-III-6 Pakharukov I.Yu., Matrosova M.M., Bukhtiyarov V.I., Parmon V.N.Concentration Hysteresis in the Oxidation of Methane over Pt/γ-Al 2 O 3 .................................................... 99OY-III-7 Konuspayeva Z.S., Auezov A.B., Konuspayev S.R., Burkitbayev M.M.,Piccolo L., Berhault G., Shaimardan M.Bimetallic Catalysts of Selective Benzene Hydrogenation for ObtainingEnvironmental Gasoline Production ............................................................................................................. 100OY-IV-1 Zyryanova М.М., Shigarov A.B., Snytnikov P.V., Belyaev V.D.,Kirillov V.A., Sobyanin V.A.Modeling of Associated Petroleum Gas Steam Reforming Process ............................................................ 102343