Dynamical multiferroicity in framework materials

Abstract

Dynamical multiferroicity, which describes the magnetic fields generated by circularly polarized phonons in materials, is an established mechanism for optical control of magnetism. Here we perform ab initio calculations of dynamical multiferroicity in inorganic and organic framework materials, with the goal of identifying materials which enable the generation of large magnetic fields by light. We find the metal--organic framework material Zn(NH$_4$)(formate)$_3$ to have modes with magnetic moments almost twice that of SrTiO$_3$; these modes involve circular motions of NH$_4^+$ hydrogen ions with high gyromagnetic ratios. The complex structure and flexibility of framework materials can allow such angular momentum localization, and also increase the maximum light-induced magnetization permitted by the Lindemann melting criterion.