1. 2019
  2. Accurate Prediction of Bond Dissociation Energies and Barrier Heights for High-Energy Caged Nitro and Nitroamino Compounds Using a Coupled Cluster Theory

    Kiselev, V. G. & Goldsmith, C. F., 13 Jun 2019, In: Journal of Physical Chemistry A. 123, 23, p. 4883-4890 8 p.

    Research output: Contribution to journalArticlepeer-review

  3. Accurate Thermochemistry of Novel Energetic Fused Tricyclic 1,2,3,4-Tetrazine Nitro Derivatives from Local Coupled Cluster Methods

    Kiselev, V. G. & Goldsmith, C. F., 14 Nov 2019, In: Journal of Physical Chemistry A. 123, 45, p. 9818-9827 10 p.

    Research output: Contribution to journalArticlepeer-review

  4. 2020
  5. Pressure DSC for energetic materials. Part 2. Switching between evaporation and thermal decomposition of 3,5-dinitropyrazole

    Gorn, M. V., Monogarov, K. A., Dalinger, I. L., Melnikov, I. N., Kiselev, V. G. & Muravyev, N. V., 1 Aug 2020, In: Thermochimica Acta. 690, 10 p., 178697.

    Research output: Contribution to journalArticlepeer-review

  6. Thermal Stability of Bis-Tetrazole and Bis-Triazole Derivatives with Long Catenated Nitrogen Chains: Quantitative Insights from High-Level Quantum Chemical Calculations

    Gorn, M. V., Gritsan, N. P., Goldsmith, C. F. & Kiselev, V. G., 24 Sept 2020, In: The journal of physical chemistry. A. 124, 38, p. 7665-7677 13 p.

    Research output: Contribution to journalArticlepeer-review

  7. Transition-metal-mediated reduction and reversible double-cyclization of cyanuric triazide to an asymmetric bitetrazolate involving cleavage of the six-membered aromatic ring

    Vaddypally, S., Kiselev, V. G., Byrne, A. N., Goldsmith, C. F. & Zdilla, M. J., 8 Dec 2020, In: Chemical Science. 12, 6, p. 2268-2275 8 p.

    Research output: Contribution to journalArticlepeer-review

  8. Nitro-, Cyano-, and Methylfuroxans, and Their Bis-Derivatives: From Green Primary to Melt-Cast Explosives

    Larin, A. A., Bystrov, D. M., Fershtat, L. L., Konnov, A. A., Makhova, N. N., Monogarov, K. A., Meerov, D. B., Melnikov, I. N., Pivkina, A. N., Kiselev, V. G. & Muravyev, N. V., 10 Dec 2020, In: Molecules (Basel, Switzerland). 25, 24, 19 p., 5836.

    Research output: Contribution to journalArticlepeer-review

  9. 2021
  10. 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

  11. 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

  12. 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

  13. 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

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