Journal of Physical Chemistry A, volume 125, issue 18, pages 3920-3927
Nitrodiaziridines: Unattainable yet, but Desired Energetic Materials
Publication type: Journal Article
Publication date: 2021-04-28
Journal:
Journal of Physical Chemistry A
Quartile SCImago
Q2
Quartile WOS
Q2
Impact factor: 2.9
ISSN: 10895639, 15205215
Physical and Theoretical Chemistry
Abstract
Using quantum chemical methods and the original technique based on atom-atom potential methods, the molecular and crystal structure simulation of all possible structural forms of nitrodiaziridines were carried out. The possible pathways of thermal decomposition of nitrodiaziridines were modeled, and the most stable forms were identified. Thermodynamic stability, physicochemical characteristics, and detonation properties were also estimated. The obtained results enable a huge potential of the nitrodiaziridine-based compounds as high-energy materials for a variety of applications.
Citations by journals
1
2
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Journal of Molecular Modeling
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Journal of Molecular Modeling
2 publications, 18.18%
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FirePhysChem
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FirePhysChem
2 publications, 18.18%
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Journal of Physical Chemistry A
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Journal of Physical Chemistry A
1 publication, 9.09%
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Chemical Engineering Journal
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Chemical Engineering Journal
1 publication, 9.09%
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Journal of Molecular Structure
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Journal of Molecular Structure
1 publication, 9.09%
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Mendeleev Communications
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Mendeleev Communications
1 publication, 9.09%
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Russian Chemical Bulletin
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Russian Chemical Bulletin
1 publication, 9.09%
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Chemical Physics
|
Chemical Physics
1 publication, 9.09%
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1
2
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Citations by publishers
1
2
3
4
5
6
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Elsevier
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Elsevier
6 publications, 54.55%
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Springer Nature
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Springer Nature
3 publications, 27.27%
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American Chemical Society (ACS)
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American Chemical Society (ACS)
1 publication, 9.09%
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6
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- We do not take into account publications that without a DOI.
- Statistics recalculated only for publications connected to researchers, organizations and labs registered on the platform.
- Statistics recalculated weekly.
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Khakimov D. et al. Nitrodiaziridines: Unattainable yet, but Desired Energetic Materials // Journal of Physical Chemistry A. 2021. Vol. 125. No. 18. pp. 3920-3927.
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Khakimov D., Fershtat L. L., Pivina T. S., Makhova N. N. Nitrodiaziridines: Unattainable yet, but Desired Energetic Materials // Journal of Physical Chemistry A. 2021. Vol. 125. No. 18. pp. 3920-3927.
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TY - JOUR
DO - 10.1021/acs.jpca.1c02960
UR - https://doi.org/10.1021%2Facs.jpca.1c02960
TI - Nitrodiaziridines: Unattainable yet, but Desired Energetic Materials
T2 - Journal of Physical Chemistry A
AU - Khakimov, Dmitry
AU - Fershtat, Leonid L.
AU - Pivina, Tatyana S
AU - Makhova, Nina N.
PY - 2021
DA - 2021/04/28 00:00:00
PB - American Chemical Society (ACS)
SP - 3920-3927
IS - 18
VL - 125
SN - 1089-5639
SN - 1520-5215
ER -
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@article{2021_Khakimov
author = {Dmitry Khakimov and Leonid L. Fershtat and Tatyana S Pivina and Nina N. Makhova},
title = {Nitrodiaziridines: Unattainable yet, but Desired Energetic Materials},
journal = {Journal of Physical Chemistry A},
year = {2021},
volume = {125},
publisher = {American Chemical Society (ACS)},
month = {apr},
url = {https://doi.org/10.1021%2Facs.jpca.1c02960},
number = {18},
pages = {3920--3927},
doi = {10.1021/acs.jpca.1c02960}
}
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MLA
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Khakimov, Dmitry, et al. “Nitrodiaziridines: Unattainable yet, but Desired Energetic Materials.” Journal of Physical Chemistry A, vol. 125, no. 18, Apr. 2021, pp. 3920-3927. https://doi.org/10.1021%2Facs.jpca.1c02960.
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