Using Near-Flat-Band Electrons for Read-Out of Molecular Spin Qubit Entangled States

While molecular spin qubits (MSQs) are a promising platform for quantum computing, read-out has been largely limited to electron paramagnetic resonance, which is often slow and requires a global system drive. Moreover, because one prerequisite for the Elzerman and Pauli spin blockade read-out mechanisms typical of semiconductor spin qubits is tunneling of electrons between sites, these read-out modalities are unavailable in MSQs. Here, we theoretically demonstrate electrical read-out of entangled MSQs via driven many-electron spin-unpolarized currents. In particular, using a time-dependent density matrix renormalization group approach, we simulate a maximally entangled MSQ pair between two electronic leads. Driving itinerant electrons between the two leads, we find that the conductance is greater when the MSQs are in the entangled singlet state compared to the entangled triplet state. This contrast in conductance is enhanced when the electronic density of states at the Fermi energy is large and for a narrow bandwidth. Our results are readily applicable to molecules supramolecularly functionalizing semiconductors with relatively flat bands, such as single-wall carbon nanotubes under a magnetic field.

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Publication Details

Journal
ACS Nano
Published
2026-02-09
DOI
https://doi.org/10.1021/acsnano.5c16530
Primary Topic
Molecular Junctions and Nanostructures
Type
article
Field-Weighted Citation Impact
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article

Using Near-Flat-Band Electrons for Read-Out of Molecular Spin Qubit Entangled States

Hai‐Ping Cheng, Silas Hoffman, Christian Bunker, Xiaoguang Zhang et al.
ACS Nano
Molecular Junctions and Nanostructures
article

Using Near-Flat-Band Electrons for Read-Out of Molecular Spin Qubit Entangled States

Hai‐Ping Cheng, Silas Hoffman, Christian Bunker, Xiaoguang Zhang, Shuanglong Liu
article en

Abstract

While molecular spin qubits (MSQs) are a promising platform for quantum computing, read-out has been largely limited to electron paramagnetic resonance, which is often slow and requires a global system drive. Moreover, because one prerequisite for the Elzerman and Pauli spin blockade read-out mechanisms typical of semiconductor spin qubits is tunneling of electrons between sites, these read-out modalities are unavailable in MSQs. Here, we theoretically demonstrate electrical read-out of entangled MSQs via driven many-electron spin-unpolarized currents. In particular, using a time-dependent density matrix renormalization group approach, we simulate a maximally entangled MSQ pair between two electronic leads. Driving itinerant electrons between the two leads, we find that the conductance is greater when the MSQs are in the entangled singlet state compared to the entangled triplet state. This contrast in conductance is enhanced when the electronic density of states at the Fermi energy is large and for a narrow bandwidth. Our results are readily applicable to molecules supramolecularly functionalizing semiconductors with relatively flat bands, such as single-wall carbon nanotubes under a magnetic field.

ACS NanoVol. 20(7)
University of Florida (US), Universidad del Noreste (MX)
Affordable and clean energy
Openalex Percentile: Top 63%
Molecular Junctions and Nanostructures
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Using Near-Flat-Band Electrons for Read-Out of Molecular Spin Qubit Entangled States — Hai‐Ping Cheng, Silas Hoffman, et al. · ACS Nano (2026) | TGRS Research Map | TGRS