Computer simulation of the crystal morphology of NiO
- 1 October 1993
- journal article
- Published by IOP Publishing in Modelling and Simulation in Materials Science and Engineering
- Vol. 1 (5) , 755-760
- https://doi.org/10.1088/0965-0393/1/5/015
Abstract
Atomistic simulation techniques based on the Born model of ionic solids have been used to calculate the surface energies and crystal morphologies of NiO and MgO. The results demonstrate the importance of Ni3+ ions for the stabilization of the (111) surface of NiO.Keywords
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