Relative energy of aluminum hydroxides: The role of electron correlation
The relative energy of aluminum mono- (boehmite and diaspore) and trihydroxides (gibbsite, bayerite, doyleite, and nordstrandite) was investigated with a periodic local Møller-Plesset second-order perturbative approach, with the aim of providing a reliable trend of stability on the basis of a proper...
| Main Authors: | , |
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| Format: | Journal Article |
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American Chemical Society
2012
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| Online Access: | http://hdl.handle.net/20.500.11937/3691 |