Magnetic Energy Landscape of Dimolybdenum Tetraacetate on a Bulk Insulator Surface
The magnetic states and the magnetic anisotropy barrier of a transition metal molecular complex, dimolybdenum tetraacetate, are investigated via density functional theory (DFT). Calculations are performed in the gas phase and on a calcite (10.4) bulk insulating surface, using the Generalized-Gradien...
Main Authors: | Matteo Cococcioni, Andrea Floris |
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Format: | Article |
Language: | English |
Published: |
MDPI AG
2021-04-01
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Series: | Applied Sciences |
Subjects: | |
Online Access: | https://www.mdpi.com/2076-3417/11/9/3806 |
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