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Antisymmetric Berry frictional force at equilibrium in the presence of spin-orbit coupling

Hung-Hsuan Teh*

Wenjie Dou†

Joseph E. Subotnik‡

  • Department of Chemistry, University of Pennsylvania, Philadelphia, Pennsylvania 19104, USA

  • School of Science, Westlake University, Hangzhou, Zhejiang 310024, China and Institute of Natural Sciences, Westlake Institute for Advanced Study, Hangzhou, Zhejiang 310024, China

  • Department of Chemistry, University of Pennsylvania, Philadelphia, Pennsylvania 19104, USA

  • *teh@sas.upenn.edu
  • †douwenjie@westlake.edu.cn
  • ‡subotnik@sas.upenn.edu

Phys. Rev. B 104, L201409 – Published 22 November, 2021

DOI: https://doi.org/10.1103/PhysRevB.104.L201409

Abstract

We analytically calculate the electronic friction tensor for a molecule near a metal surface in the case where the electronic Hamiltonian is complex valued, e.g., the case where there is spin-orbit coupling and/or an external magnetic field. In such a case, even at equilibrium, we show that the friction tensor is not symmetric. Instead, the tensor is the real-valued sum of one positive definite tensor (corresponding to dissipation) plus one antisymmetric tensor (corresponding to a Berry pseudomagnetic force). Moreover, we find that this Berry force can be much larger than the dissipational force, suggesting the possibility of strongly spin-polarized chemicurrents or strongly spin-dependent rate constants for systems with spin-orbit coupling.

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