Publication

Large impact of phonon lineshapes on the superconductivity of solid hydrogen

Lorenzo Monacelli
2024
Journal paper
Abstract

Phonon anharmonicity plays a crucial role in determining the stability and vibrational properties of high-pressure hydrides. Furthermore, strong anharmonicity can render phonon quasiparticle picture obsolete questioning standard approaches for modeling superconductivity in these material systems. In this work, we show the effects of non-Lorentzian phonon lineshapes on the superconductivity of high-pressure solid hydrogen. We calculate the superconducting critical temperature TC ab initio considering the full phonon spectral function and show that it overall enhances the TC estimate. The anharmonicity-induced phonon softening exhibited in spectral functions increases the estimate of the critical temperature, while the broadening of phonon lines due to phonon-phonon interaction decreases it. Our calculations also reveal that superconductivity emerges in hydrogen in the C m c a - 12 molecular phase VI at pressures between 450 and 500 GPa and explain the disagreement between the previous theoretical results and experiments.|This work studies the effects of non-gaussian phonon lineshapes from stochastic self-consistent harmonic approximation on the superconducting critical temperature (Tc) of hydrogen at high pressure. It predicts superconductivity in the Cmca-12 phase between 450 and 500 GPa and an increase in Tc for both the Cmca-12 and the I41/amd-2 structures compared to harmonic calculations.

About this result
This page is automatically generated and may contain information that is not correct, complete, up-to-date, or relevant to your search query. The same applies to every other page on this website. Please make sure to verify the information with EPFL's official sources.

Graph Chatbot

Chat with Graph Search

Ask any question about EPFL courses, lectures, exercises, research, news, etc. or try the example questions below.

DISCLAIMER: The Graph Chatbot is not programmed to provide explicit or categorical answers to your questions. Rather, it transforms your questions into API requests that are distributed across the various IT services officially administered by EPFL. Its purpose is solely to collect and recommend relevant references to content that you can explore to help you answer your questions.