Some Observations on the Structure of TATB
- Los Alamos National Laboratory
The recent discovery of second-harmonic light generation (SHG) from 1,3,5-triamino-2,4,6-trinitrobenzene (TATB) has renewed interest in both the crystallography and the identification of defect structures in this material. The accepted crystal structure is triclinic but centrosymmetric (P-1); SHG is not expected from materials of this symmetry. A wide variety of syntheses have been shown to produce SHG-positive materials, including an emulsion technique, two different recrystallization methods, and a variety of combined reaction - precipitation processes. In addition, two standard commercial powders have shown the property after annealing in the 300 C range. We have examined the structures of several of these powders using polarized light microscopy (PLM), scanning electron microscopy (SEM), and powder X-ray diffraction (XRD). We find that SHG-positive materials typically contain crystals both more transparent and more strongly faceted (i.e. ''more perfect'') than weak-SHG ones and that the positive samples show stronger texture in their powder diffraction patterns. These results are compared with predictions from Cady's structure.
- Research Organization:
- Los Alamos National Lab., NM (US)
- Sponsoring Organization:
- USDOE Office of Defense Programs (DP) (US)
- DOE Contract Number:
- W-7405-ENG-36
- OSTI ID:
- 761024
- Report Number(s):
- LA-UR-99-3397
- Country of Publication:
- United States
- Language:
- English
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