aiqbench analysis
This study demonstrates a novel application of quantum algorithms—specifically Harrow-Hassidim-Lloyd and Variational Quantum Linear Solver—to solve Non-Equilibrium Green's Function problems for nano-scale electron transport. By mapping the scattering problem to compact circuits requiring only 3–4 physical qubits, researchers validate NEGF implementation on actual IBM hardware while addressing noise constraints. The work highlights a concrete pathway toward using quantum processors for complex nanoscale simulations that are intractable for classical methods.
Training Quantum Dragons
arXiv:2607.27168v1 Announce Type: new Abstract: The Non-Equilibrium Green's Function (NEGF) is the standard formalism for nano-scale electron transport. By recasting the NEGF scattering problem as a linear system of equations whose solution encodes the transmission and reflection amplitudes, we present the first quantum computerized implementation of NEGF. We apply both the Harrow--Hassidim--Lloyd and Variational Quantum Linear Solver algorithms to compute the transmission coefficient $T(E)$ of quantum dragon nanodevices within the single-band tight-binding model. Quantum dragon devices exhibit perfect transmission across the full conducting band regardless of internal disorder. The problem maps onto compact circuits of 3 and 4 total physical qubits for the 2-site and 6-site dragon devices, respectively. A similarity transformation block-diagonalizes the NEGF linear system reducing the Pauli decomposition of the block-encoded matrix. We demonstrate the feasibility of quantum computation by performing ideal and noise-aware simulations and computations on physical IBM quantum processor.
Abstract:The Non-Equilibrium Green's Function (NEGF) is the standard formalism for nano-scale electron transport. By recasting the NEGF scattering problem as a linear system of equations whose solution encodes the transmission and reflection amplitudes, we present the first quantum computerized implementation of NEGF. We apply both the Harrow--Hassidim--Lloyd and Variational Quantum Linear Solver algorithms to compute the transmission coefficient $T(E)$ of quantum dragon nanodevices within the single-band tight-binding model. Quantum dragon devices exhibit perfect transmission across the full conducting band regardless of internal disorder. The problem maps onto compact circuits of 3 and 4 total physical qubits for the 2-site and 6-site dragon devices, respectively. A similarity transformation block-diagonalizes the NEGF linear system reducing the Pauli decomposition of the block-encoded matrix. We demonstrate the feasibility of quantum computation by performing ideal and noise-aware simulations and computations on physical IBM quantum processor.
arXiv:2607.27168 [quant-ph]
(or arXiv:2607.27168v1 [quant-ph] for this version)
https://doi.org/10.48550/arXiv.2607.27168 Focus to learn more arXiv-issued DOI via DataCite (pending registration)
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