Calculation of strain and polarization fields at the surface of MgO crystals. Breathing shell model
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.434626
Reference10 articles.
1. Lattice dynamics of magnesium oxide
2. A new model for lattice dynamics (“breathing shell model”)
3. Calculations of Dispersion Curves and Specific Heat for LiF and NaCl Using the Breathing Shell Model
4. Accelerating the Jacobi Method for Solving Simultaneous Equations by Chebyshev Extrapolation When the Eigenvalues of the Iteration Matrix are Complex
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3. Energy and Structure of (001) Coincident-Site Twist Boundaries and the Free (001) Surface in MgO: A Theoretical Study;Journal of the American Ceramic Society;2006-10-04
4. Evolution of classical/quantum methodologies: applications to oxide surfaces and interfaces;Coordination Chemistry Reviews;2003-03
5. MgO(100) surface relaxation and vacancy defects: a semi-empirical quantum-chemical study;Physical Chemistry Chemical Physics;1999
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