Adsorption of H2O on TiO2: Difference between revisions
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== Task == | == Task == | ||
In this example you will | In this example you will investigate the adsorption of H<sub>2></sub>O on a TiO<sub>2</sub> surface by means of standard geometry optimisation ("relaxation") and by means of constrained molecular dynamics. | ||
== Download == | == Download == | ||
Revision as of 17:58, 23 June 2019
Task
In this example you will investigate the adsorption of H2>O 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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