Modeling ammonium nitrate explosive properties

 

Nuianzin Vitalii

National University of Civil Protection of Ukraine

https://orcid.org/0000-0003-4785-0814

 

Tregubov Dmytro

National University of Civil Protection of Ukraine

https://orcid.org/0000-0003-1821-822X

 

Maiboroda Artem

National University of Civil Protection of Ukraine

https://orcid.org/0000-0001-6108-9772

 

Trefilova Larisa

National University of Civil Protection of Ukraine

https://orcid.org/0000-0001-9061-4206

 

Mazurov Volodymyr

National University of Civil Protection of Ukraine

https://orcid.org/0009-0009-0415-7834

 

DOI: https://doi.org/10.52363/2524-0226-2025-42-11

 

Keywords: ammonium nitrate, explosiveness, supramolecular structure, cluster, detonation ability, damage radius

 

Аnnotation

 

The ideas about occurrence mechanisms of agricultural ammonium nitrate explosive properties are systematized. It is shown that they only partially describe the such events randomness without substantiating development clear mechanisms. The directions of saltpeter properties changes under different additives and storage conditions, as well as ways to increase it structure stability during storage, are systematized. Mechanisms for preventing the explosiveness occurrence for agro-mixtures of nitrate with ammonium sulfate or calcium carbonate were compared. Schemes of saltpeter chemical transformations during decomposition at temperature influence or other initiation routes are presented. It is shown that it explosion specific TNT equivalent varies within 0.45–1.35, depending on the accompanying factors set. The possible explosion consequences for 3.000 tons saltpeter assessed based on the average TNT equivalent. The possible consequences of 10.000 tons saltpeter agro-mixtures explosion with a disturbed composition were assessed according to the participation coefficient in the explosion. Modeling of ammonium nitrate supramolecular structure variants for the stable state and for the explosive transformations initiation moment was carried out based on the determining the detonation ability index KD using the "melting ease" index. It was established that the scheme "linear cluster based on nitrobase" gives a high indicator KD >1, which does not correspond to reality; for tetragonal lattices KD < 1 was obtained, which shows the explosive properties absence; under crystal structure destruction conditions, for dimers with a clustering scheme with nitro groups “facing each other”, KD >1 was obtained, which determines significant explosive properties. The forming different supramolecular structures possibility determines the forming different explosive proper-ties ability.

 

References

 

  1. Trehubov, D. H., Minsʹka, N. V., Hapon, Yu. K., Tarakhno, O. V. (2024). Teoriya protsesiv horinnya, vybukhu ta pozhezhohasinnya. Kharkiv: NUTSZ Ukrayiny. Available at: http://repositsc.nuczu.edu.ua/handle/123456789/20224
  2. Tregubov, D., Minska, N., Slepuzhnikov, E., Hapon, Yu., Sokolov, D. (2022). Substances explosive properties formation. Problems of Emergency Situations, 36, 41–53. doi: 10.52363/2524-0226-2022-36-4
  3. Honcharov, O. (2020). Amiachna selitra: dobre dobryvo z nedobroyu vdacheyu. Сh2. AgroONE, 59(10), 10–15. Available at: https://www. agroone.info/publication/ amiachna-selitra-dobre-dobrivo-z-nedobroju-vdacheju-2/
  4. Tsopa, V., Cheberyachko, S., Deryugin, O., Sushko, N., Stanislavchuk, О. (2023). Analysis of the causes of the ammonium nitrate explosion in the port of Beirut. Bulletin of Lviv State University of Life Safety, 27, 95–108. doi: 10.32447/

20784643.27.2023.11

  1. Mariz, J., Soofastaei, A. (2022). Advanced Analytics for Rock Blasting and Explosives Engineering in Mining. Advanced Analytics in Mining Engineering. Switzerland: Springer, Cham, 363–477. doi: 10.1007/978-3-030-91589-6_13
  2. Kuskovets, S., Fylypchuk, V., Kuskovets, А. (2022). Explosion and fire safety of ammonia nitrate in the conditions of its long-term storage. Bulletin National University of Water and Environmental Engineering. Technical sciences, 1(97), 336–345. Available at: https://ep3.nuwm.edu.ua/24835/
  3. Guidance for sea transport of solid ammonium nitrate based fertilizers. (2024). Brussels, Belgium: Fertilizers Europe. Available at: https://www.fertilizerseurope.com/ ?s=ammonium+nitrate
  4. Reetz, H. (2018). Fertilizers and their Efficient Use. Paris, France: IFA. Availa-ble at: https://www.fertilizer.org/wp-content/uploads/2023/01/2016_ifa_reetz.pdf
  5. Poplawski, D., Hoffmann, J., Hoffmann, K. (2016). Effect of carbonate minerals on the thermal stability of fertilisers containing ammonium nitrate. Journal of Thermal Analysis and Calorimetry, 124(3), 1–14. doi: 10.1007/s10973-015-5229-1
  6. Tsadilas, C. (2022). Nitrate Handbook: Environmental, Agricultural, and Health Effects. Boca Raton, Florida: CRC Press. doi: 10.1201/9780429326806
  7. Negovanovic, M., Kricak, L., Milanoviс, S., Dokiс, N., Simic, N. (2015). Ammonium nitrate explosion hazards. Podzemni radovi, 27, 49–63. doi:10.5937/podrad1527049N
  8. Meyer, R., Köhler, J., Homberg, A. (2016). Explosives. Weinheim: Wiley-VCH. ISBN: 9783527689613
  9. Tarakhno, O. V., Trehubov, D. H., Zhernoklʹov, K. V., Kovrehin, V. V. (2020). Osnovni polozhennya protsesu horinnya. Vynyknennya protsesu horinnya. Kh.: NUTSZU. Available at: http://repositsc.nuczu.edu.ua/handle/123456789/11382
  10. Himanshu, V., Mishra, A., Roy, M., Singh, P. (2023). Blasting Technology for Underground Hard Rock Mining. Singapore: Springer. doi: 10.1007/978-981-99-2645-9
  11. Babrauskas, V., Leggett, D. (2020). Thermal decomposition of ammonium nitrate. Fire and Materials, 44(2), 250–268. doi: 10.1002/fam.2797
  12. Tregubov, D., Slepuzhnikov, E., Chyrkina, M., Maiboroda, A. (2023). Cluster Mechanism of the Explosive Processes Initiation in the Matter. Key Engineering Materials, 952, 131–142. doi: 10.4028/p-lZz2Hq
  13. TU U 24.1-05607 824-041:2024. (2024). Vapnyakovo-amiachna selitra (VAS). Tekhnichni umovy. Minekonomiky. Rivno: DP «Lʹvivstandartmetrolohiya».
  14. Skyba, O., Briankin, S., Rybachok, D., Lukianets, O., Ozeran, H. (2025). Improvement of methodological aspects of testing fire structures and protective shelters for resistance to excess pressure of a shock blast wave. Scientific works of State Scientific Research Institute of Armament and Military Equipment Testing and Certification, 2(24), 96–102. doi: 10.37701/dndivsovt.24.2025.11
  15. Tregubov, D., Tarahno, O., Sokolov, D., Trehubova, F. (2021). The identification of hydrocarbons cluster structure by melting point. Problems of Emergency Situations, 34, 94–109. doi: 10.52363/2524-0226-2021-34-7
  16. Tregubov, D., Trefilova, L., Minska, N., Hapon, Yu., Sokolov, D. (2024). Nonlinearities correlation of n-alkanes and n-alcohols physicochemical properties. Problems of Emergency Situations, 1(39), 4–24. doi: 10.52363/2524-0226-2024-39-1
  17. Hapon, Yu., Tregubov, D., Slepuzhnikov, E., Lypovyi, V. (2022). Cluster Structure Control of Coatings by Electrochemical Coprecipitation of Metals to Obtain Target Technological Properties. Solid State Phenomena, 334, 70–76. doi: 10.4028/p-4ws8gz
  18. Djerdjev, A. M., Priyananda, P., Gore, J., Beattie, J. K., Neto, Ch., Hawkett, B. S. (2018). The mechanism of the spontaneous detonation of ammonium nitrate in reactive grounds. Journal of Environmental Chemical Engineering, 6(1), 281–288. doi: 10.1016/j.jece.2017.12.003
  19. Wang, X., Chenxi, P., Xingliang, W., Feiyang, X., Nian, Y., Dabin, L., Sen, X. (2022). Experiment-based cause analysis of secondary explosion of ammonium nitrate in fire conditions. Journal of Loss Prevention in the Process Industries, 77, 104780. doi: 10.1016/j.jlp.2022.104780
  20. Kaim, S. D. (2021). High-Energy Ejection of Molecules and Gas-Dust Outbursts in Coal Mines. Entropy (Basel), 23(12), 1638. doi: 10.3390/e23121638