First principles studies of water and ice on oxide surfaces
The interaction of water (and ice) with oxide surfaces has been studied with first principles density functional theory. To begin, an extensive series of studies on the clay mineral kaolinite (Al_2Si_2O_5(OH)_4) are reported with a view to understanding the efficacy of kaolinite as a heterogeneous i...
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University College London (University of London)
2010
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Online Access: | http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.564900 |