Cover Image

Hyperfine Coupling Constants on Quantum Computers: Performance, Errors, and Future Prospects

Fuente: arXiv

Saved in:

Bibliographic Details
Main Authors:	Jensen, Phillip W. K., Hedemark, Gustav Stausbøll, Ziems, Karl Michael, Kjellgren, Erik Rosendahl, Reinholdt, Peter, Knecht, Stefan, Coriani, Sonia, Kongsted, Jacob, Sauer, Stephan P. A.
Format:	Preprint
Published:	2025
Subjects:	Quantum Physics Chemical Physics Computational Physics
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Redundant parameter dependencies in truncated classic and quantum Linear Response and Equation of Motion theory
by: Kjellgren, Erik Rosendahl, et al.
Published: (2025)

Critical Limitations in Quantum-Selected Configuration Interaction Methods
by: Reinholdt, Peter, et al.
Published: (2025)

Which options exist for NISQ-friendly linear response formulations?
by: Ziems, Karl Michael, et al.
Published: (2023)

Quantum Equation of Motion with Orbital Optimization for Computing Molecular Properties in Near-Term Quantum Computing
by: Jensen, Phillip W. K., et al.
Published: (2023)

Self-consistent Quantum Linear Response with a Polarizable Embedding environment
by: Reinholdt, Peter, et al.
Published: (2024)

Divergences in classical and quantum linear response and equation of motion formulations
by: Kjellgren, Erik Rosendahl, et al.
Published: (2024)

Exact closed-form expression for unitary spin-adapted fermionic singlet double excitation operators
by: Kjellgren, Erik Rosendahl, et al.
Published: (2025)

Understanding and mitigating noise in molecular quantum linear response for spectroscopic properties on quantum computers
by: Ziems, Karl Michael, et al.
Published: (2024)

Orbital-Optimized Unitary Coupled Cluster for Indirect Nuclear Spin-Spin Coupling Constants within a Quantum Linear Response Framework
by: Fuglsbjerg, Juliane H., et al.
Published: (2025)

Subspace methods for the simulation of molecular response properties on a quantum computer
by: Reinholdt, Peter, et al.
Published: (2024)

Electric Field Gradient Calculations for Ice VIII and IX using Polarizable Embedding: A Comparative Study on Classical Computers and Quantum Simulators
by: Nagy, Dániel, et al.
Published: (2024)

Quantum error mitigation using energy sampling and extrapolation enhanced Clifford data regression
by: Zhao, Zhongqi, et al.
Published: (2025)

Cost-effective scalable quantum error mitigation for tiled Ansätze
by: Rasmussen, Oskar Graulund Lentz, et al.
Published: (2025)

Reduced density matrix formulation of quantum linear response
by: von Buchwald, Theo Juncker, et al.
Published: (2024)

The variational quantum eigensolver self-consistent field method within a polarizable embedded framework
by: Kjellgren, Erik Rosendahl, et al.
Published: (2023)

Reduced density matrix and cumulant approximations of quantum linear response
by: von Buchwald, Theo Juncker, et al.
Published: (2025)

Linear Response Selected Configuration Interaction
by: Reinholdt, Peter, et al.
Published: (2025)

State-Averaged Quantum Algorithms for Multiconfigurational Surface Chemistry: A Benchmark on Rh@TiO2(110)
by: Larsson, Ernst Dennis Lægteskov Binau, et al.
Published: (2026)

Multiconfigurational short-range on-top pair-density functional theory
by: Jørgensen, Frederik Kamper, et al.
Published: (2024)

A Lanczos-based algorithm for sum-over-states calculations of NMR spin--spin coupling constants at the RPA level of theory: The Fermi-contact term
by: Zahn, Sarah L. V., et al.
Published: (2026)

X-ray Absorption Spectra for Aqueous Ammonia and Ammonium: Quantum Mechanical versus Molecular Mechanical Embedding Schemes
by: Folkestad, Sarai Dery, et al.
Published: (2024)

Tackling instabilities of quantum Krylov subspace methods: an analysis of the numerical and statistical errors
by: Oliveira, Maria Gabriela Jordão, et al.
Published: (2026)

Velocity Formulations for Hyper-Rayleigh Scattering Optical Activity Spectroscopy: Addressing the Origin-dependence Problem
by: Bonvicini, Andrea, et al.
Published: (2026)

Hyperfine-Resolved Rotational Spectroscopy of HCNH+
by: Silva, Weslley G. D. P., et al.
Published: (2024)

Exact Factorization of Unitary Transformations with Spin-Adapted Generators
by: Jain, Paarth, et al.
Published: (2025)

GPU-accelerated Higher Representations of Wilson Fermions with HiRep
by: Martins, Sofie, et al.
Published: (2024)

Hyperfine-to-rotational energy transfer in ultracold atom-molecule collisions
by: Liu, Yi-Xiang, et al.
Published: (2024)

Hyperfine Structure of Quantum Entanglement
by: Mo, Liang-Hong, et al.
Published: (2023)

Muonium Hyperfine Splitting Uncertainty Revisited
by: Eides, Michael I.
Published: (2025)

Current Density Formulation of Nuclear Magnetic Shielding and Magnetizability Tensors in Paramagnetic Molecules in the Presence of Relativistic Effects
by: Summa, Francesco Ferdinando, et al.
Published: (2026)

Hyperfine and Zeeman interactions in ultracold collisions of molecular hydrogen with atomic lithium
by: Jóźwiak, Hubert, et al.
Published: (2023)

Formulation and Implementation of Frequency-Dependent Linear Response Properties with Relativistic Coupled Cluster Theory for GPU-accelerated Computer Architectures
by: Yuan, Xiang, et al.
Published: (2023)

Hyperfine spectroscopy of optical-cycling transitions in singly ionized thulium
by: Müller, Patrick, et al.
Published: (2025)

Hyperfine structure and $K$-doubling in RaOCH$_3$ molecule
by: Petrov, Alexander
Published: (2025)

Hyperfine splittings of heavy quarkonium hybrids
by: Soto, Joan, et al.
Published: (2023)

The advent of fully variational quantum eigensolvers using a hybrid multiresolution approach
by: Langkabel, Fabian, et al.
Published: (2024)

All-Optical Universal Control of Hyperfine Qudits in Trapped Neutral Atoms
by: Krondorfer, Johannes K., et al.
Published: (2026)

Quantifying Light-assisted Collisions in Optical Tweezers Across the Hyperfine Spectrum
by: Pampel, Steven K., et al.
Published: (2024)

Proton-Size Resolution of the Hyperfine Puzzle in Hydrogen
by: Miller, Gerald A.
Published: (2026)

Hyperfine van der Waals repulsion between open-shell polar molecules
by: Walraven, Etienne F., et al.
Published: (2025)