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  1. 2025

  2. Quantum-Chemical Simulation of Multiresonance Thermally Activated Delayed Fluorescence Materials Based on B,N-Heteroarenes Using Graph Neural Networks

    Tarakanovskaya, D. D. & Mostovich, E. A., 8 May 2025, In: Journal of Physical Chemistry A. 129, 20, p. 4458-4470 13 p.

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

  3. Catalysts for ethanol dry reforming based on high-entropy perovskites

    Eremeev, N. F., Hanna, S. A., Sadovskaya, E. M., Leonova, A. A., Bulavchenko, O. A., Ishchenko, A. V., Prosvirin, I. P., Sadykov, V. A. & Bespalko, Y. N., May 2025, In: Journal of Catalysis. 445, 116028.

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

  4. Role of chirality in photoinduced electron transfer in pentapeptide (L)-His-(L/D)-Asp-(L/D)-Ser-Gly-(L)Tyr in solutions

    Magin, I. M., Lukyanov, R. S., Ageeva, A. A., Kruppa, A. I., Polyakov, N. E. & Leshina, T. V., 1 Apr 2025, In: Journal of Photochemistry and Photobiology A: Chemistry. 461, 1169164.

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

  5. Volumetric properties of aqueous solutions of small monohydric alcohols. Molecular dynamics simulation

    Nichiporenko, V. A., Kadtsyn, E. D. & Medvedev, N. N., 1 Apr 2025, In: Journal of Molecular Liquids. 423, 127005.

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

  6. The key role of oxide phases covering dispersed metals in their catalytic activity and stability in hydrolysis of boron-containing hydrides

    Komova, O. V., Ozerova, A. M., Rudneva, Y. V., Simagina, V. I., Lipatnikova, I. L., Rogov, V. A., Prosvirin, I. P. & Netskina, O. V., 20 Mar 2025, In: International Journal of Hydrogen Energy. 111, p. 361-370 10 p.

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

  7. What Is More Important When Calculating the Thermodynamic Properties of Organic Crystals, Density Functional, Supercell, or Energy Second-Order Derivative Method Choice?

    Dubok, A. S. & Rychkov, D. A., 16 Mar 2025, In: Crystals. 15, 3, 274.

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

  8. Template Synthesis of Macroporous Tin(IV) Oxide for its Use as an Electrocatalyst Support

    Chikunova, Y. O., Vorobieva, E. E., Moseenkov, S. I., Parkhomchuk, E. V., Gribov, E. N., Shaparenko, N. O. & Kozlov, D. V., 10 Mar 2025, In: Journal of Structural Chemistry. 66, 2, p. 369-385 17 p.

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

  9. A new approach to lanthanum silicates with apatite structure synthesis using β-cyclodextrin

    Lopatin, M. Y., Sadovskaya, E. M., Ksenz, A. S., Vorobyova, A. A., Boltalin, A. I., Knotko, A. V., Sorokina, N. M., Shatalova, T. B., Petukhov, D. I., Fedorova, Y. E., Eremeev, N. F., Sadykov, V. A., Morozov, I. V. & Fedorova, A. A., 5 Mar 2025, In: Colloids and Surfaces A: Physicochemical and Engineering Aspects. 708, 135979.

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

  10. Chemotherapeutic Boron-Containing Homocysteinamides of Human Serum Albumin

    Wang, M., Tsyrempilov, S. A., Moskalev, I. A., Zakharova, O. D., Kasatova, A. I., Sil’nikov, V. N., Godovikova, T. S. & Popova, T. V., 12 Feb 2025, In: Russian Journal of Bioorganic Chemistry. 51, 1, p. 354-371 18 p.

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

  11. Correction to: Chemical Structure of Lean and Stoichiometric Laminar Flames of Methylcyclohexane at Atmospheric Pressure (Energies, (2024), 17, 23, (6154), 10.3390/en17236154)

    Matyushkov, V. V., Chernov, A. A., Dmitriev, A. M. & Shmakov, A. G., 6 Feb 2025, In: Energies. 18, 3, 1 p., 736.

    Research output: Contribution to journal › Comment/debate › peer-review

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