Ab initio description of magnetic and critical properties of spin-glass pyrochlore NaSrMn2F7

In this study, I have investigated the magnetic and critical properties of manganese pyrochlore fluoride NaSrMn2F7, which exhibits a glass transition at Tf = 2.5 (K) due to charge disorder. A DFT + U + SOC framework is used in this paper to derive spin-Hamiltonian terms, including isotropic and anis...

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Bibliographic Details
Main Author: Mohammad Amirabbasi
Format: Article
Language:English
Published: AIP Publishing LLC 2023-05-01
Series:AIP Advances
Online Access:http://dx.doi.org/10.1063/5.0142124