<i>mrfmsim</i> : A modular, extendable, and readable simulation package for magnetic resonance force microscopy experiments

We present mrfmsim, an open-source Python package that facilitates the design, simulation, and analysis of magnetic resonance force microscopy (MRFM) experiments. MRFM is a scanning-probe technique that detects magnetic resonance from nanoscale ensembles of nuclear or electron spins with a force sensor. Because MRFM experiments are complex and operate at sensitivity limits, numerical simulation is essential for designing experiments and estimating per-spin sensitivity and imaging resolution from measured signals. In this paper, we highlight the challenges of developing MRFM simulations and show that software designed to simulate specific experiments only in a rapidly evolving experimental field can yield erroneous results. The mrfmsim package addresses these challenges by supporting post-definition customization without rewriting the internal model and by employing a plugin system for extending functionality. We show that the package's modular, extendable, and readable architecture improves reproducibility and accelerates development.

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Publication Details

Journal
The Journal of Chemical Physics
Published
2026-06-09
DOI
https://doi.org/10.1063/5.0332386
Primary Topic
Force Microscopy Techniques and Applications
Type
article
Field-Weighted Citation Impact
0.00

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article

mrfmsim : A modular, extendable, and readable simulation package for magnetic resonance force microscopy experiments

Eric W. Moore, Corinne E. Isaac, Michael C. Boucher, John A. Marohn et al.
The Journal of Chemical Physics
Force Microscopy Techniques and Applications
article

mrfmsim : A modular, extendable, and readable simulation package for magnetic resonance force microscopy experiments

Eric W. Moore, Corinne E. Isaac, Michael C. Boucher, John A. Marohn, Z Jane Wang, Peter Sun
article en

Abstract

We present mrfmsim, an open-source Python package that facilitates the design, simulation, and analysis of magnetic resonance force microscopy (MRFM) experiments. MRFM is a scanning-probe technique that detects magnetic resonance from nanoscale ensembles of nuclear or electron spins with a force sensor. Because MRFM experiments are complex and operate at sensitivity limits, numerical simulation is essential for designing experiments and estimating per-spin sensitivity and imaging resolution from measured signals. In this paper, we highlight the challenges of developing MRFM simulations and show that software designed to simulate specific experiments only in a rapidly evolving experimental field can yield erroneous results. The mrfmsim package addresses these challenges by supporting post-definition customization without rewriting the internal model and by employing a plugin system for extending functionality. We show that the package's modular, extendable, and readable architecture improves reproducibility and accelerates development.

The Journal of Chemical PhysicsVol. 164(22)
Cornell University (US)
National Institutes of Health, Army Research Office
Industry, innovation and infrastructure
Openalex Percentile: Top 6%
Force Microscopy Techniques and Applications
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<i>mrfmsim</i> : A modular, extendable, and readable simulation package for magnetic resonance force microscopy experiments — Eric W. Moore, Corinne E. Isaac, et al. · The Journal of Chemical Physics (2026) | TGRS Research Map | TGRS