Article ID Journal Published Year Pages File Type
1811921 Physica B: Condensed Matter 2011 9 Pages PDF
Abstract
►Magnetic and binding properties of metal-divacancy complexes at MgO surface. ►Spin quenching occurs for some metals. ►Cation vacancy end enhances the adsorption. ►The metal-support interactions stabilize the low spin states. ►Variations in properties are correlated with frontier orbitals, spin contamination, and electrostatic potentials.
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Related Topics
Physical Sciences and Engineering Physics and Astronomy Condensed Matter Physics
Preview
Magnetic and binding properties of metal-divacancy complexes at MgO (0 0 1) surface: DFT calculations
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