Adsorption of H2O on TiO2: Difference between revisions
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[ | [[Media:tutorial_h2o_on_tio2.pdf| Adsorption of H<sub>2</sub> on TiO<sub>2</sub>]]: A guide to this example. | ||
[[Media:h2o_on_tio2.tgz| h2o_on_tio2.tgz]] | [[Media:h2o_on_tio2.tgz| h2o_on_tio2.tgz]] | ||
Latest revision as of 13:13, 14 November 2019
Task
In this example you will investigate the adsorption of H2O on a TiO2 surface by means of standard geometry optimisation ("relaxation") and by means of constrained molecular dynamics.
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Adsorption of H2 on TiO2: A guide to this example.
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