1. 2025
  2. Kinetic Isotope Effect in the Unfolding of a Protein Secondary Structure: Calculations for Beta-Sheet Polyglycine Dimers as a Model

    Яншин, А. О., Kiselev, V. & Бакланов, А. В., 9 Jan 2025, In: Biomedicines. 15, 1, 12 p., 2561.

    Research output: Contribution to journalArticlepeer-review

  3. 2024
  4. Too fast and too furious: thermoanalytical and quantum chemical study of the thermal stability of 4,4′-dinitro-3,3′-diazenofuroxan

    Kiselev, V. G., Sadykov, A. R., Melnikov, I. N., Fomenkov, I. V., Fershtat, L. L., Pivkina, A. N. & Muravyev, N. V., 4 Dec 2024, In: Physical Chemistry Chemical Physics. 26, 47, p. 29541-29551 11 p.

    Research output: Contribution to journalArticlepeer-review

  5. Metal-Free Reversible Double Cyclization of Cyanuric Diazide to an Asymmetric Bitetrazolate via Cleavage of the Six-Membered Aromatic Ring

    Vaddypally, S., Byrne, A. N., Goldsmith, C. F., Zdilla, M. J. & Kiselev, V. G., 5 Feb 2024, In: Inorganic Chemistry. 63, 5, p. 2322-2326 5 p.

    Research output: Contribution to journalArticlepeer-review

  6. Ion chemistry in ammonia-hydrogen-oxygen flames

    Cherepanov, A. V., Kiselev, V. G., Dmitriev, A. M., Osipova, K. N., Shmakov, A. G. & Knyazkov, D. A., Jan 2024, In: Proceedings of the Combustion Institute. 40, 1-4, 7 p., 105584.

    Research output: Contribution to journalArticlepeer-review

  7. 2023
  8. New Mechanistic Insights into the Primary Thermolysis Reactions of 1,3,4,6-Tetranitrooctahydroimidazo-[4,5-d]imidazole (BCHMX) from Predictive Local Coupled Cluster Calculations

    Melnikov, I. N., Pivkina, A. N. & Kiselev, V. G., 28 Dec 2023, In: The journal of physical chemistry. A. 127, 51, p. 10860-10871 12 p.

    Research output: Contribution to journalArticlepeer-review

  9. A detailed chemical kinetic mechanism of 1,1-diamino-2,2-dinitroethylene (FOX-7) initial decomposition in the gas phase

    Lyu, J. Y., Zhu, Q., Bai, X., Ren, X., Li, J., Chen, D., Kiselev, V. G., Li, Y. & Yang, W., Sept 2023, In: Combustion and Flame. 255, 14 p., 112877.

    Research output: Contribution to journalArticlepeer-review

  10. The Nature of the Enthalpy-Entropy Compensation and "Exotic" Arrhenius Parameters in the Denaturation Kinetics of Proteins

    Baklanov, A. V. & Kiselev, V. G., 25 Jun 2023, In: International Journal of Molecular Sciences. 24, 13, 10630.

    Research output: Contribution to journalArticlepeer-review

  11. A new look at the structure of the neutral Au18 cluster: hollow versus filled golden cage

    Nhat, P. V., Si, N. T., Fielicke, A., Kiselev, V. G. & Nguyen, M. T., 29 Mar 2023, In: Physical chemistry chemical physics : PCCP. 25, 13, p. 9036-9042 7 p.

    Research output: Contribution to journalArticlepeer-review

  12. Thermochemistry, Tautomerism, and Thermal Stability of 5,7-Dinitrobenzotriazoles

    Melnikov, I. N., Kiselev, V. G., Dalinger, I. L., Starosotnikov, A. M., Muravyev, N. V. & Pivkina, A. N., 10 Mar 2023, In: International Journal of Molecular Sciences. 24, 6, 5330.

    Research output: Contribution to journalArticlepeer-review

  13. Experimental and kinetic modeling study of the positive ions in premixed ethylene flames over a range of equivalence ratios

    Knyazkov, D. A., Cherepanov, V., Kiselev, V. G., Gerasimov, I. E., Kasper, T. & Shmakov, A. G., 2023, In: Proceedings of the Combustion Institute. 39, 2, p. 1753-1761 9 p.

    Research output: Contribution to journalArticlepeer-review

  14. 2022
  15. Thermal stability of energetic 6,8-dinitrotriazolo[1,5-a]pyridines: Interplay of thermal analysis and quantitative quantum chemical calculations

    Melnikov, I. N., Kiselev, V. G., Bastrakov, M. A., Dalinger, I. L. & Pivkina, A. N., Nov 2022, In: Thermochimica Acta. 717, 179342.

    Research output: Contribution to journalArticlepeer-review

  16. Cationic structure of premixed near-stoichiometric CH4/O2/Ar flames at atmospheric pressure: New insights from mass spectrometry, quantum chemistry, and kinetic modeling

    Knyazkov, D. A., Gerasimov, I. E., Bolshova, T. A., Kiselev, V. G., Shmakov, A. G. & Paletsky, A. A., Jul 2022, In: Combustion and Flame. 241, 112106.

    Research output: Contribution to journalArticlepeer-review

  17. Autocatalytic decomposition of energetic materials: interplay of theory and thermal analysis in the study of 5-amino-3,4-dinitropyrazole thermolysis

    Muravyev, N. V., Gorn, M. V., Melnikov, I. N., Monogarov, K. A., Korsunskii, B. L., Dalinger, I. L., Pivkina, A. N. & Kiselev, V. G., 17 Jun 2022, In: Physical Chemistry Chemical Physics. 24, 26, p. 16325-16342 18 p.

    Research output: Contribution to journalArticlepeer-review

  18. Unexpected structures of the Au17 gold cluster: the stars are shining

    Nhat, P. V., Si, N. T., Kiselev, V. G., Fielicke, A., Pham, H. T. & Nguyen, M. T., 10 May 2022, In: Chemical Communications. 58, 38, p. 5785-5788 4 p.

    Research output: Contribution to journalArticlepeer-review

  19. Практические занятия по квантовой химии

    Горбунов, Д. Е., Грицан, Н. П. & Киселев, В. Г., 2022, Новосибирск: ИПЦ НГУ. 40 p.

    Research output: Book/ReportTeaching manualpeer-review

  20. 2021
  21. Another look at energetically quasi-degenerate structures of the gold cluster Au27q with q = 1, 0, −1

    Nhat, P. V., Si, N. T., Kiselev, V. G. & Nguyen, M. T., 15 Nov 2021, In: Journal of Computational Chemistry. 42, 30, p. 2145-2153 9 p.

    Research output: Contribution to journalArticlepeer-review

  22. Nitrogen-rich metal-free salts: a new look at the 5-(trinitromethyl)tetrazolate anion as an energetic moiety

    Chaplygin, D. A., Larin, A. A., Muravyev, N. V., Meerov, D. B., Kosareva, E. K., Kiselev, V. G., Pivkina, A. N., Ananyev, I. V. & Fershtat, L. L., 21 Oct 2021, In: Dalton Transactions. 50, 39, p. 13778-13785 8 p.

    Research output: Contribution to journalArticlepeer-review

  23. Learning to fly: thermochemistry of energetic materials by modified thermogravimetric analysis and highly accurate quantum chemical calculations

    Muravyev, N. V., Monogarov, K. A., Melnikov, I. N., Pivkina, A. N. & Kiselev, V. G., 7 Aug 2021, In: Physical Chemistry Chemical Physics. 23, 29, p. 15522-15542 21 p.

    Research output: Contribution to journalArticlepeer-review

  24. Nitroderivatives of N-pyrazolyltetrazoles: Thermal decomposition and combustion

    Sinditskii, V. P., Smirnova, A. D., Serushkin, V. V., Yudin, N. V., Vatsadze, I. A., Dalinger, I. L., Kiselev, V. G. & Sheremetev, A. B., Apr 2021, In: Thermochimica Acta. 698, 178876.

    Research output: Contribution to journalArticlepeer-review

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