Many-Body Effects in a Molecular Quantum NAND Tree

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1. Verfasser: Bergfield, Justin P.
Format: Preprint
Veröffentlicht: 2025
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author Bergfield, Justin P.
author_facet Bergfield, Justin P.
contents Molecules provide the smallest possible circuits in which quantum interference and electron correlation can be engineered to perform logical operations, including the universal NAND gate. We investigate a chemically encoded quantum NAND tree based on alkynyl-extended iso-polyacetylene backbones, where inputs are set by end-group substitution and outputs are read from the presence or absence of transmission nodes. Using quantum many-body transport theory, we show that NAND behavior persists in the presence of dynamic correlations, but that the nodal positions and their chemical shifts depend sensitively on electron-electron interactions. This sensitivity highlights the potential of these systems not only to probe the strength of electronic correlations but also to harness them in shaping logical response. The thermopower is identified as a chemically robust readout of gate logic, providing discrimination margins that greatly exceed typical experimental uncertainties, in an observable governed primarily by the variation of transport rather than its absolute magnitude.
format Preprint
id arxiv_https___arxiv_org_abs_2510_06438
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Many-Body Effects in a Molecular Quantum NAND Tree
Bergfield, Justin P.
Mesoscale and Nanoscale Physics
Other Condensed Matter
Chemical Physics
Molecules provide the smallest possible circuits in which quantum interference and electron correlation can be engineered to perform logical operations, including the universal NAND gate. We investigate a chemically encoded quantum NAND tree based on alkynyl-extended iso-polyacetylene backbones, where inputs are set by end-group substitution and outputs are read from the presence or absence of transmission nodes. Using quantum many-body transport theory, we show that NAND behavior persists in the presence of dynamic correlations, but that the nodal positions and their chemical shifts depend sensitively on electron-electron interactions. This sensitivity highlights the potential of these systems not only to probe the strength of electronic correlations but also to harness them in shaping logical response. The thermopower is identified as a chemically robust readout of gate logic, providing discrimination margins that greatly exceed typical experimental uncertainties, in an observable governed primarily by the variation of transport rather than its absolute magnitude.
title Many-Body Effects in a Molecular Quantum NAND Tree
topic Mesoscale and Nanoscale Physics
Other Condensed Matter
Chemical Physics
url https://arxiv.org/abs/2510.06438