Adsorption of H2O on TiO2: Difference between revisions
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Revision as of 17:52, 23 June 2019
Task
In this example you will determine the transition state in the flipping of NH3 by means of the Nudged-Elastic-Band (NEB) Method and the Improved Dimer Method.
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Adsorption of H2 on TiO2: A guide to this example.
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