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    • DFT modeling
    Authors

    3 results in DFT modeling in Keywords: DFT modeling

    Category: Catalysis
    ,
    Working Paper
    , Title:

    Will We Witness Enzymatic or Pd-(Oligo)peptide Catalysis in Suzuki Cross-Coupling Reactions?

    , Authors: Vlada V. Petrova, Yaroslav V. Solovev, Yuri B. Porozov, Mikhail V. Polynski
    Version 2 posted 12 January 2024
    449
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    1
    Citations
    Category: Inorganic Chemistry
    ,
    Working Paper
    , Title:

    Geometry and local environment of surface sites in Vanadium-based Ziegler-Natta catalysts from 51V solid-state NMR Spectroscopy

    , Authors: Sebastian Sabisch, Yuya Kakiuchi, Scott R. Docherty, Alexander V. Yakimov, Christophe Copéret
    Version 3 posted 19 October 2023
    535
    Downloads
    Category: Polymer Science
    ,
    Working Paper
    , Title:

    Controlling molar mass and dispersity in polymers through deuteration: the case of poly(phenyl D3-vinyl sulfide)

    , Authors: Anastasia Kutskaya, Mikhail Polynski, Konstantin Rodygin, Nina Demchenko, Valentine Ananikov
    Version 1 posted 14 May 2024
    220
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