Tucker, M. G. and Dove, M. T. and Keen, D. A. and Goodwin, A. L. and Wells, S. A. and Hui, Q. (2005) Getting the most from total scattering. Acta Crystallographica, A61. C95.
Full text not available from this repository.Abstract
Total scattering, an extension of the powder diffraction method, is increasingly being used to study crystalline materials. The unique combination of Bragg and diffuse scattering can be used to determine both the average structure and the short-range fluctuations from this average within a single experiment. To maximise the structural information from such data three-dimensional atomic models consistent with all aspects of the data are required. Here I present a technique for producing such models based on the reverse Monte Carlo (RMC) method. The existing RMC method has been expanded to take explicit account of the Bragg intensity profile from crystalline materials
| Item Type: | Article |
|---|---|
| Uncontrolled Keywords: | 2006 AREP IA50 2005 P |
| Subjects: | 03 - Mineral Sciences |
| Divisions: | 03 - Mineral Sciences |
| Journal or Publication Title: | Acta Crystallographica |
| Volume: | A61 |
| Page Range: | C95 |
| Depositing User: | Sarah Humbert |
| Date Deposited: | 08 Nov 2010 16:52 |
| Last Modified: | 23 Jul 2013 09:59 |
| URI: | http://eprints.esc.cam.ac.uk/id/eprint/1853 |
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