Dataset for Compensated ferrimagnets with colossal spin splitting in organic compounds
| About | This dataset is associated with a study on exotic collinear antiferromagnets focusing on altermagnetism and compensated ferrimagnets that exhibit unique spin splittings in their electronic band structures. Altermagnets show anisotropic spin splitting, while compensated ferrimagnets have isotropic spin splitting. This research proposes the realization of such ferrimagnets in a new organic compound, (EDO-TTF-I)$_2$ClO$_4$, based on $ab$ $initio$ calculations. This repository includes the data including input and output data for ab initio calculations by Quantum ESPRESSO, downfolding by RESPACK, and the many-variable variational Monte Carlo method by mVMC. |
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| URL | https://isspns-gitlab.issp.u-tokyo.ac.jp/k-yoshimi/edottf |
| DOI | https://doi.org/10.1103/PhysRevLett.132.156502 |
| Authors | Taiki Kawamura , Kazuyoshi Yoshimi , Kenichiro Hashimoto , Akito Kobayashi , Takahiro Misawa |
| License | CC BY 4.0 |
| Category | Electronic structure (solid state physics) , Strong correlation/effective models |
| References | Taiki Kawamura, Kazuyoshi Yoshimi, Kenichiro Hashimoto, Akito Kobayashi, and Takahiro Misawa Phys. Rev. Lett. 132, 156502(2024). |
| Related software | Quantum ESPRESSO, RESPACK, mVMC |
| Contact ※Please replace __at__ with @. |
k-yoshimi__at__issp.u-tokyo.ac.jp,tmisawa__at__issp.u-tokyo.ac.jp,akito__at__s.phys.nagoya-u.ac.jp |
| Note |