A computational study of magnesium point defects and diffusion in forsterite
We have studied the formation and migration of point defects within the magnesium sub-lattice inforsterite using a combination of empirical and quantum mechanical modelling methodologies. Empiricalmodels based on a parameterised force field coupled to a high throughput grid computing infrastructurea...
| Main Authors: | , , , |
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| Format: | Journal Article |
| Published: |
Elsevier
2009
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| Subjects: | |
| Online Access: | http://hdl.handle.net/20.500.11937/37170 |