Transmutation in 90SrF2: A density functional theory study of phase stability in ZrF2
The stability of multiple possible phases of ZrF2 is computed using density-functional theory. Motivated by radioactive samples of fluorite 90SrF2 stored at the Hanford site, we consider β− radioactive decay as the route by which the 90ZrF2 is generated. To find suitable structures for the ZrF2 comp...
| Main Authors: | , , , |
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| Format: | Journal Article |
| Published: |
American Physical Society
2012
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| Online Access: | http://hdl.handle.net/20.500.11937/25062 |