Exploration of multiple energy landscapes for zirconia nanoclusters
Abstract
We have predicted the stable and low-energy metastable structures for (ZrO2)n
- This article is part of the themed collection: Solid State Structure Prediction
* Corresponding authors
a
University College London, Department of Chemistry, Materials Chemistry, 3rd Floor, Kathleen Lonsdale Building, Gower Street, London, United Kingdom
E-mail:
scott.woodley@ucl.ac.uk
b Department of Physical, Chemical and Natural Systems, University Pablo de Olavide, Ctra. Utrera km 1, 41013 Sevilla, Spain
We have predicted the stable and low-energy metastable structures for (ZrO2)n
S. M. Woodley, S. Hamad and C. R. A. Catlow, Phys. Chem. Chem. Phys., 2010, 12, 8454 DOI: 10.1039/C0CP00057D
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