Structural properties and spin-phonon coupling in orthorhombic Y-substituted GdMnO$_{3}$

TL;DR

This study investigates the structural and lattice dynamic properties of Y-substituted GdMnO3 manganites, revealing how Y substitution influences distortions, bond angles, and spin-phonon interactions at various temperatures.

Contribution

It provides a detailed analysis of the correlation between structural distortions and spin-phonon coupling in Gd$_{1-x}$Y$_{x}$MnO$_{3}$, highlighting the effects of Y substitution on these properties.

Findings

Jahn-Teller distortion remains constant with Y substitution.

Mn-O1-Mn bond angle increases with Y content.

Spin-phonon coupling affects phonon frequency shifts.

Abstract

We present a systematic study of the structure and lattice dynamics at room temperature, and the phonon behavior at low temperatures in orthorhombic Gd$_{1-x}$Y$_{x}$MnO$_{3}$ manganites, with 0 $\leq$ x $\leq$ 0.4, using powder x-ray diffraction and Raman scattering. A thorough analysis towards the correlation between both structural and Raman modes parameters was undertaken. The data obtained at room temperature reveal structural distortions arising from the Jahn-Teller distortion and octahedra tilting. The Jahn-Teller distortion is apparently x-independent, while an increase of Mn-O1-Mn bond angle of about 0.5{\deg} could be ascertain when x changes from 0 to 0.4. Spin-phonon coupling was evidenced from the Raman results. The temperature dependence of the B1g in-plane O2 stretching mode of the MnO6 octahedron has revealed either a positive or negative shift regarding the pure anharmonic temperature dependence of the phonon frequency, which strongly depends on the Y-concentration. The frequency renormalization is explained in terms of a competition between ferro and antiferromagnetic interactions. The ratio between the spin-phonon coupling constant and the effective magnetic exchange integral per spin was determined from the renormalized wave number of the in-plane O2 stretching mode, associated with the spin-spin correlation function.