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Simulation of Ozone and Molecular Oxygen Oxidation of Dinitrogen Tetroxide to Nitric Anhydride

Dmitry Victorovich Khakimov 1
Dmitry Victorovich Khakimov
Ilya Vladimirovich Kuchurov 1
Ilya Vladimirovich Kuchurov
Igor Vladimirovich Fomenkov 1
Igor Vladimirovich Fomenkov
Tatyana Stepanovna Pivina 1
Tatyana Stepanovna Pivina
Sergei Grigorievich Zlotin 1
Sergei Grigorievich Zlotin
Vladimir Alexandrovich Tartakovsky
Published 2014-02-21
CommunicationVolume 24, Issue 2, 94-95
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Khakimov D. V. et al. Simulation of Ozone and Molecular Oxygen Oxidation of Dinitrogen Tetroxide to Nitric Anhydride // Mendeleev Communications. 2014. Vol. 24. No. 2. pp. 94-95.
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Khakimov D. V., Kuchurov I. V., Fomenkov I. V., Pivina T. S., Zlotin S. G., Tartakovsky V. A. Simulation of Ozone and Molecular Oxygen Oxidation of Dinitrogen Tetroxide to Nitric Anhydride // Mendeleev Communications. 2014. Vol. 24. No. 2. pp. 94-95.
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TY - JOUR
DO - 10.1016/j.mencom.2014.03.009
UR - https://mendcomm.colab.ws/publications/10.1016/j.mencom.2014.03.009
TI - Simulation of Ozone and Molecular Oxygen Oxidation of Dinitrogen Tetroxide to Nitric Anhydride
T2 - Mendeleev Communications
AU - Khakimov, Dmitry Victorovich
AU - Kuchurov, Ilya Vladimirovich
AU - Fomenkov, Igor Vladimirovich
AU - Pivina, Tatyana Stepanovna
AU - Zlotin, Sergei Grigorievich
AU - Tartakovsky, Vladimir Alexandrovich
PY - 2014
DA - 2014/02/21
PB - Mendeleev Communications
SP - 94-95
IS - 2
VL - 24
ER -
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@article{2014_Khakimov,
author = {Dmitry Victorovich Khakimov and Ilya Vladimirovich Kuchurov and Igor Vladimirovich Fomenkov and Tatyana Stepanovna Pivina and Sergei Grigorievich Zlotin and Vladimir Alexandrovich Tartakovsky},
title = {Simulation of Ozone and Molecular Oxygen Oxidation of Dinitrogen Tetroxide to Nitric Anhydride},
journal = {Mendeleev Communications},
year = {2014},
volume = {24},
publisher = {Mendeleev Communications},
month = {Feb},
url = {https://mendcomm.colab.ws/publications/10.1016/j.mencom.2014.03.009},
number = {2},
pages = {94--95},
doi = {10.1016/j.mencom.2014.03.009}
}
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Khakimov, Dmitry Victorovich, et al. “Simulation of Ozone and Molecular Oxygen Oxidation of Dinitrogen Tetroxide to Nitric Anhydride.” Mendeleev Communications, vol. 24, no. 2, Feb. 2014, pp. 94-95. https://mendcomm.colab.ws/publications/10.1016/j.mencom.2014.03.009.

Abstract

The oxidations of N2O4 to N2O5 with ozone or molecular oxygen were simulated using quantum chemistry (DFT) and computer modeling (Gaussian 98 program package) methods.

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