تقرير
Spin-Phonon Coupling in Transition Metal Insulators: General Computational Approach and Application to MnPSe$_3$
| العنوان: | Spin-Phonon Coupling in Transition Metal Insulators: General Computational Approach and Application to MnPSe$_3$ |
|---|---|
| المؤلفون: | Dhakal, Ramesh, Griffith, Samuel, Choi, Kate, Winter, Stephen M. |
| سنة النشر: | 2024 |
| المجموعة: | Condensed Matter |
| مصطلحات موضوعية: | Condensed Matter - Strongly Correlated Electrons |
| الوصف: | Spin-phonon coupling underlies a number of diverse range of phenomena of recent interest, particularly in transition metal insulators with strong spin-orbit effects, where it may give rise to hybrid magnetoelastic excitations, and the controversial phonon thermal Hall effect. In this work, we describe a general approach to the first principles estimation of generic spin-orbit-phonon couplings suitable for investigating these diverse effects. The method is demonstrated by application to study the temperature-dependent optical phonon lineshapes in MnPSe$_3$, for which we find quantitative agreement with recent experiments. Comment: 21 pages, 7 figures |
| نوع الوثيقة: | Working Paper |
| URL الوصول: | http://arxiv.org/abs/2407.00659 |
| رقم الأكسشن: | edsarx.2407.00659 |
| قاعدة البيانات: | arXiv |
| الوصف غير متاح. |