ISIS Neutron and Muon Source Data Journal
This is a page describing data taken during an experiment at the ISIS Neutron and Muon Source. Information about the ISIS Neutron and Muon Source can be found at https://www.isis.stfc.ac.uk.
A High-Pressure investigation on 3,4,5-Trinitropyrazole
Abstract: This proposal will explore the effect of elevated pressure on the 3,4,5-Trinitropyrazole (TNP). TNP releases a large amount of dinitrogen gas as a detonation product which is neither toxic nor environmentally harmful, unlike most conventional explosives. They produce less carbon monoxide, soot and other oxidised toxic explosive residues. TNP is therefore considered as green energetic material. We are proposing a careful high-pressure neutron diffraction studyon TNP under hydrostatic conditions, with the aims of (i) identifying the evolution of structure as a function of pressure, including the changes in intermolecular interactions, (ii) determining reliable equations of state for TNP. These experimental resultswill be compared with the outputs from DFT-D calculations. These results will provide an enhanced understanding of the behaviour of this new energetic material.
Public release date: 01 November 2022
Principal Investigator: Dr Sumit Konar
Experimenter: Miss nurunnisa atceken
Experimenter: Dr Craig Bull
Experimenter: Professor Colin Pulham
Experimenter: Mr AKACHAI KHUMSRI
DOI: 10.5286/ISIS.E.RB1920623-2
Parent DOI: 10.5286/ISIS.E.RB1920623
ISIS Experiment Number: RB1920623
Part Number: 2
Date of Experiment: 18 October 2019
Publisher: STFC ISIS Neutron and Muon Source
Data format: RAW/Nexus
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Data Citation
The recommended format for citing this dataset in a research
publication is as:
[author], [date], [title], [publisher],
[doi]
For Example:
Dr Sumit Konar et al; (2019): A High-Pressure investigation on 3,4,5-Trinitropyrazole, STFC ISIS Neutron and Muon Source, https://doi.org/10.5286/ISIS.E.RB1920623-2
