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Published in 2017 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.6b12789
Abstract: Open-shell molecules on metal oxide surfaces frequently display cooperative adsorption mechanisms, where pairs of adsorbates are significantly more stable than the isolated species. In this work, density functional theory is used to investigate the cooperative…
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Keywords:
density functional;
oxide surfaces;
surfaces influence;
influence reactivity ... See more keywords