Issue 18, 2023

On the use of Monkhorst–Pack scheme to evaluate superconductivity and the issue of umklapp electron–phonon interactions

Abstract

The Monkhorst–Pack scheme is a method to save time in the days of slow computers. It excludes umklapp phonons with significant consequences. Its widespread application to evaluate superconductivity arises from the desire to reduce phonon contributions to solve a historical difficulty of the BCS theory. An alternative method turns out to be more accurate in Pb and Pd.

Graphical abstract: On the use of Monkhorst–Pack scheme to evaluate superconductivity and the issue of umklapp electron–phonon interactions

Article information

Article type
Paper
Submitted
06 Mar 2023
Accepted
19 Apr 2023
First published
21 Apr 2023
This article is Open Access
Creative Commons BY license

Phys. Chem. Chem. Phys., 2023,25, 13049-13060

On the use of Monkhorst–Pack scheme to evaluate superconductivity and the issue of umklapp electron–phonon interactions

X. H. Zheng and J. X. Zheng, Phys. Chem. Chem. Phys., 2023, 25, 13049 DOI: 10.1039/D3CP01053H

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