Dataset of tensorial optical and transport properties of materials from the Wannier function method
Abstract The discovery of functional materials for energy harvesting and electronic applications require accurate predictions of their optical and transport properties. While several existing datasets contain the optical and transport properties calculated from first-principles calculations, the amo...
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| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
Nature Portfolio
2025-07-01
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| Series: | Scientific Data |
| Online Access: | https://doi.org/10.1038/s41597-025-05396-9 |
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