| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 7157595 | Defence Technology | 2018 | 27 Pages |
Abstract
FOX-7 and its cisoid and transoid 1,5-tautomers as well as magnesium composites of all have been investigated quantum chemically within the restrictions of density functional theory (B3LYP/6-311++G(d,p)). Certain physico-chemical and quantum chemical properties, energies, stabilities, calculated IR and UV-VIS spectra are discussed. The influence of magnesium atom is investigated. It has been found that in FOX-7 composites the magnesium is not a silent ingredient, but interacts with the organic constituents.
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Authors
Lemi Türker,