Computer modelling of hydrogen defects in the clinopyroxenes diopside and jadeite
Atomistic computer simulation techniques have been employed to model mechanisms of hydrogen incorporation in the clinopyroxenes diopside and jadeite. Calculation of solution reaction energies for the pure phases indicates that hydrogen is most easily incorporated via the formation of [VSi(OH)4]x h...
| Main Authors: | , |
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| Format: | Journal Article |
| Published: |
Springer-Verlag GmbH
2006
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| Subjects: | |
| Online Access: | http://hdl.handle.net/20.500.11937/35679 |