Hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) is a cyclic nitroamine explosive that is a major component in many military high-explosive formulations. In this study, two aerobic bacteria that are capable of using RDX as the sole source of carbon and nitrogen to support their growth were isolated from surface soil. These bacterial strains were identified by their fatty acid profiles and 16S ribo...

We investigated the fate of explosives compounds in slurries containing fractured and weathered soil particles. Three soils were crushed with a piston to emulate detonation-induced fracturing. We used X-ray diffraction, scanning electron microscopy and gas adsorption surface area measurements to quantify the mineralogies and surfaces of the weathered and fractured soil particles. Soil batch slu...

The ab initio crystal density, bond topological and explosive properties of the energetic molecule 2-methyl-5-nitraminotetrazole (MNAT) have been calculated by the MOLPAK/PMIN software and the AIM theory. The density predicted from the crystal structure simulation almost matches the experimental density. The geometrical parameters of the molecule lifted from the crystal structure are in very cl...

Hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) is a cyclic nitramine explosive commonly used for military applications that is responsible for severe soil and groundwater contamination. In this study, Shewanella oneidensis MR-1 was shown to efficiently degrade RDX anaerobically (3.5 µmol·h(-1)·(g protein)(-1)) via two initial routes: (1) sequential N-NO(2) reductions to the corresponding nitro...

Abstract The electrochemical reduction of four organic explosive compounds, 1,3,5,7‐tetranitro‐1,3,5,7‐tetrazocane (HMX), 1,3,5‐trinitro‐1,3,5‐triazinane (RDX), pentaerythritol tetranitrate (PETN) and 2,4,6‐trinitrophenylmethylnitramine (tetryl), is studied in eight room temperature ionic liquids (RTILs). In all RTILs, the peaks were highly complicated, but much better resolved than previous st...

A theoretical two-phase-flow analysis is developed to describe the quasi-steady propagation, across a pressure jump, of a multi-phase deflagration in confined porous energetic materials. The difference, or overpressure, between the upstream (unburned) and downstream (burned) gas pressure leads to a more complex structure than that which is obtained for an unconfined deflagration in which the pr...

A highly sensitive screening method based on high performance liquid chromatography atmospheric pressure ionization mass spectrometry (HPLC-API-MS) has been developed for the analysis of 21 nitroaromatic, nitramine and nitrate ester explosives, which include the explosives most commonly encountered in forensic science. Two atmospheric pressure ionization (API) methods, atmospheric pressure chem...

In contrast to past studies of thermal decomposition mechanisms of explosives designed to determine the detailed chemical pathways by which these large organic molecules are transformed into small reaction products (N2, NO, N2O, HCN, CO, CO2, H2O, etc.)—crucial to predicting long-term stability for storage; sensitivity to heat and mechanical impact; and risk assessment associated with their usa...

In this work, by using density functional theory, the adsorption of Nitramide (NH2NO2) molecule on the surface of pristine, B, As and B&As doped (4,4) armchair aluminum nitride nanotube (AlNNTs) is investigated. From optimized structures the adsorption energy, deformation energy, natural bond orbital (NBO), atom in molecule (AIM), quantum parameters, reduced density gradient (RDG) and molecular...