DifFault: Simulation of diffraction patterns of faulted crystals
We have developed a software library called DifFault to generate X-ray diffraction (XRD) patterns of cubic structures. The simulation of the XRD peak profiles in the patterns is based on physical principles and accounts for the effects of crystallite size, dislocations, and planar faults. The progra...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2024-09-01
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| Series: | SoftwareX |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2352711024002309 |