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  1. 2025

  2. Paramagnetic Gas Adsorbed in Metal-Organic Framework: A Promising Platform for Spin Qubits Design

    Yazikova, A. A., Tomilov, A. S., Afimchenko, N. A., Zilberberg, I. L., Melnikov, A. R., Smirnova, K. A., Poryvaev, A. S. & Fedin, M. V., 16 Apr 2025, In: Journal of Physical Chemistry C. 9 p.

    Research output: Contribution to journal › Article › peer-review

  3. 2022

  4. Structure and Properties of Exotic Nano- and Mesodiamonds with Pentagonal Symmetry

    Tomilin, F. N., Pomogaev, V. A., Melchakova, Y. A., Artyushenko, P. V., Shubin, A. A., Volodin, A. M., Zilberberg, I. L. & Avramov, P. V., Mar 2022, In: Russian Physics Journal. 64, 11, p. 2046-2051 6 p.

    Research output: Contribution to journal › Article › peer-review

  5. 2021

  6. Projection of single-determinant solutions of spin-polarized self-consistent field equations in the basis set of spin-paired orbitals

    Ovchinnikov, D. A., Ruzankin, S. F., Kovalskii, V. Y. & Zilberberg, I. L., Aug 2021, In: Journal of Structural Chemistry. 62, 8, p. 1147-1166 20 p.

    Research output: Contribution to journal › Article › peer-review

  7. The FeIV-O• oxyl unit as a key intermediate in water oxidation on the FeIII-hydroxide: DFT predictions

    Shubin, A. A., Kovalskii, V. Y., Ruzankin, S. P., Zilberberg, I. L., Parmon, V. N., Tomilin, F. N. & Avramov, P. V., 15 May 2021, In: International Journal of Quantum Chemistry. 121, 10, e26610.

    Research output: Contribution to journal › Article › peer-review

  8. Entropy driven preference for alkene adsorption at the pore mouth as the origin of pore-mouth catalysis for alkane hydroisomerization in 1D zeolites

    Shubin, A. A. & Zilberberg, I. L., 21 Jan 2021, In: Catalysis Science and Technology. 11, 2, p. 563-574 12 p.

    Research output: Contribution to journal › Article › peer-review

  9. 2020

  10. The Charge Transfer Complex Formed between the Components of Photopolymer Material as an Internal Sensitizer of Spectral Sensitivity

    Derevyanko, D. I., Shelkovnikov, V. V., Kovalskii, V. Y., Zilberberg, I. L., Aliev, S. I., Orlova, N. A. & Ugozhaev, V. D., 15 Oct 2020, In: ChemistrySelect. 5, 38, p. 11939-11947 9 p.

    Research output: Contribution to journal › Article › peer-review

  11. Oxygen transport in Pr nickelates: Elucidation of atomic-scale features

    Sadykov, V., Pikalova, E., Eremeev, N., Shubin, A., Zilberberg, I., Prosvirin, I., Sadovskaya, E. & Bukhtiyarov, A., 1 Jan 2020, In: Solid State Ionics. 344, 9 p., 115155.

    Research output: Contribution to journal › Article › peer-review

  12. 2019

  13. Using Doping to Modify the Properties of SrFeO 3 and SrCoO 3 Oxides: DFT Calculations of the Electronic Structure

    Gainutdinov, I. I., Nemudry, A. P. & Zilberberg, I. L., 1 Feb 2019, In: Journal of Structural Chemistry. 60, 2, p. 171-178 8 p.

    Research output: Contribution to journal › Article › peer-review

  14. Ab initio molecular dynamic study of structure and atomic motions in SrCoO3-x and SrCo0.875Mo0.125O3-x

    Gainutdinov, I., Nemudry, A. & Zilberberg, I., 2019, In: Materials Today: Proceedings. 25, p. 435-438 4 p.

    Research output: Contribution to journal › Conference article › peer-review

  15. The influence of A- And B-cation substitution on electronic structure of SrFeO3 and SrCoO3

    Gainutdinov, I. I., Nemudry, A. P. & Zilberberg, I. L., 2019, In: Materials Today: Proceedings. 12, p. 21-24 4 p.

    Research output: Contribution to journal › Conference article › peer-review

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