materialscloud:2019.0020/v1
Published May 20, 2019 | Version v1
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Data-driven studies of magnetic two-dimensional materials

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  • 1. Department of Physics, Harvard University, 17 Oxford street, Cambridge MA 02138

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Description

We use a data-driven approach to study the magnetic and thermodynamic properties of van der Waals (vdW) layered materials. We investigate monolayers of the form A2B2X6, based on the known material Cr2Ge2Te6, using density functional theory (DFT) calculations and determine their magnetic properties, such as magnetic order and magnetic moment. We also examine formation energies and use them as a proxy for chemical stability.

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References

Journal reference (Paper where the data is discussed)
T.D. Rhone, W. Chen, S. Desai, A. Yacoby, E. Kaxiras, Data-driven studies of magnetic two-dimensional materials. Sci Rep 10, 15795 (2020)., doi: 10.1038/s41598-020-72811-z