Optimally localized single-band Wannier functions for two-dimensional Chern insulators
The construction of optimally localized Wannier functions (and Wannier functions in general) for a Chern insulator has been considered to be impossible owing to the fact that the second moment of such functions is generally infinite. In this article, we propose a solution to this problem in the case...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
American Physical Society
2024-04-01
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| Series: | Physical Review Research |
| Online Access: | http://doi.org/10.1103/PhysRevResearch.6.023046 |
| Summary: | The construction of optimally localized Wannier functions (and Wannier functions in general) for a Chern insulator has been considered to be impossible owing to the fact that the second moment of such functions is generally infinite. In this article, we propose a solution to this problem in the case of a single band isolated from the rest of the band structure. We accomplish this by drawing an analogy between the minimization of the variance and the minimization of the electrostatic energy of a periodic array of point charges in a smooth neutralizing background. In doing so, we obtain a natural regularization of the diverging variance and this leads to an analytical solution to the minimization problem. We demonstrate our results numerically for a particular model system. Furthermore, we show how the optimally localized Wannier functions provide a natural way of evaluating the electric polarization for a Chern insulator. |
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| ISSN: | 2643-1564 |