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Preserving fermionic statistics for single-particle approximations in microscopic quantum master equations

arXiv
Authors: Mikayla Z. Fahrenbruch, Anthony W. Schlimgen, Kade Head-Marsden

Year

2025

Paper ID

17677

Status

Preprint

Abstract Read

~2 min

Abstract Words

127

Citations

N/A

Abstract

Microscopic master equations have gained traction for the dissipative treatment of molecular spin and solid-state systems for quantum technologies. Single particle approximations are often invoked to treat these systems, which can lead to unphysical evolution when combined with master equation approaches. We present a mathematical constraint on the system-environment parameters to ensure that microscopically-derived Markovian master equations preserve fermionic, N-representable statistics when applied to reduced systems. We demonstrate these constraints for the recently derived unified master equation and universal Lindblad equation, along with the Redfield master equation for cases when positivity issues are not present. For operators that break the constraint, we explore the addition of Pauli factors to recover N-representability. This work promotes feasible applications of novel microscopic master equations for realistic chemical systems.

Why This Paper Matters

  • This paper contributes to the Quantum Chemistry research area in the Quantum Articles archive.
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  • Microscopic master equations have gained traction for the dissipative treatment of molecular spin and solid-state systems for quantum technologies.

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