Electron spin mediated distortion in metallic systems

TL;DR

This paper explores how electron spin influences atomic distortion in metallic systems, linking magnetic properties to structural changes, especially in chromium alloys, to better understand and design materials with desirable features.

Contribution

It introduces a novel explanation of metallic distortion driven by electron spin and magnetovolume effects, focusing on chromium alloys and their magnetic properties.

Findings

Distortion in Cr alloys is significantly affected by magnetic ground states.

Magnetovolume effects correlate with charge disproportion and spin-flip phenomena.

Fermi surface nesting influences structural distortions in metallic systems.

Abstract

The deviation of positions of atoms from their ideal lattice sites in crystalline solid state systems causes distortion and can lead to variation in structural [1] and functional properties [2]. Distortion in molecular systems has been traditionally understood in the term of Jahn-Teller distortion [3], while for the one-dimensional chain of metals, the Peierls distortion mechanism has been proposed [4]. In a real three dimensional metallic systems, a fundamental description of the distortion is missing, which we need to design alloys with attractive structural properties. The present investigation presents the evolution of distortion in metallic systems in terms of magnetovolume effects arising due to magnetic ground-state of the system. Particularly the significant distortion in the case of Cr due to presence of other transition metals is seen. Cr alloyed with transition metals as a candidate system to study the correlation between charge disproportion, spin-flip, magnetovolume effects and Fermi surface nesting. This study provides a novel explanation of strengthening effect of Cr observed in alloys due to its unique magnetic properties.