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The inverse Henderson problem of statistical mechanics concerns classical particles in continuous space which interact according to a pair potential depending on the distance of the particles. Roughly stated, it asks for the interaction…

Mathematical Physics · Physics 2019-10-15 Fabio Frommer , Martin Hanke , Sabine Jansen

We establish the geometric ergodicity of the preconditioned Hamiltonian Monte Carlo (HMC) algorithm defined on an infinite-dimensional Hilbert space, as developed in [Beskos et al., Stochastic Process. Appl., 2011]. This algorithm can be…

Statistics Theory · Mathematics 2020-03-19 Nathan E. Glatt-Holtz , Cecilia F. Mondaini

We develop a generalized Newton scheme IHNC for the construction of effective pair potentials for systems of interacting point-like particles.The construction is made in such a way that the distribution of the particles matches a given…

Numerical Analysis · Mathematics 2018-07-02 Fabrice Delbary , Martin Hanke , Dmitry Ivanizki

We address the numerical solution of infinite-dimensional inverse problems in the framework of Bayesian inference. In the Part I companion to this paper (arXiv.org:1308.1313), we considered the linearized infinite-dimensional inverse…

Methodology · Statistics 2014-04-14 Noemi Petra , James Martin , Georg Stadler , Omar Ghattas

By formulating the inverse problem of partial differential equations (PDEs) as a statistical inference problem, the Bayesian approach provides a general framework for quantifying uncertainties. In the inverse problem of PDEs, parameters are…

Numerical Analysis · Mathematics 2026-02-10 Haoyu Lu , Junxiong Jia , Deyu Meng

The montecarlo method, which is quite commonly used to solve maximum entropy problems in statistical physics, can actually be used to solve inverse problems in a much wider context. The probability distribution which maximizes entropy can…

Statistical Mechanics · Physics 2007-05-23 Jan Naudts

The inverse potential problem consists in determining the density of the volume potential from measurements outside the sources. Its ill-posedness is due both to the non-uniqueness of the solution and to the instability of the solution with…

Numerical Analysis · Mathematics 2025-10-07 P. N. Vabishchevich

Hessian operators arising in inverse problems governed by partial differential equations (PDEs) play a critical role in delivering efficient, dimension-independent convergence for both Newton solution of deterministic inverse problems, as…

This paper presents a systematic study of the relative entropy technique for compressible motions of continuum bodies described as Hamiltonian flows. While the description for the classical mechanics of $N$ particles involves a Hamiltonian…

Analysis of PDEs · Mathematics 2024-02-01 Jan Giesselmann , Kiwoong Kwon , Min-Gi Lee

The Hamiltonian Monte Carlo (HMC) method allows sampling from continuous densities. Favorable scaling with dimension has led to wide adoption of HMC by the statistics community. Modern auto-differentiating software should allow more…

Computation · Statistics 2022-08-17 Ian Langmore , Michael Dikovsky , Scott Geraedts , Peter Norgaard , Rob von Behren

The well-known Heisenberg--Robertson uncertainty relation for a pair of noncommuting observables, is expressed in terms of the product of variances and the commutator among the operators, computed for the quantum state of a system.…

Quantum Physics · Physics 2019-09-25 David Puertas Centeno , Mariela Portesi

High-throughput characterization often requires estimating parameters and model dimension from experimental data of limited quantity and quality. Such data may result in an ill-posed inverse problem, where multiple sets of parameters and…

Quantum Physics · Physics 2026-04-08 Abigail N. Poteshman , Jiwon Yun , Tim H. Taminiau , Giulia Galli

The iterative Boltzmann inversion is an iterative scheme to determine an effective pair potential for an ensemble of identical particles in thermal equilibrium from the corresponding radial distribution function. Although the method is…

Mathematical Physics · Physics 2018-01-17 Martin Hanke

Recent work has shown that probabilistic models based on pairwise interactions-in the simplest case, the Ising model-provide surprisingly accurate descriptions of experiments on real biological networks ranging from neurons to genes.…

Quantitative Methods · Quantitative Biology 2007-12-18 Tamara Broderick , Miroslav Dudik , Gasper Tkacik , Robert E. Schapire , William Bialek

We evaluate the relative entropy on a ball region near the UV fixed point of a holographic conformal field theory deformed by a fermionic operator of nonzero vacuum expectation value. The positivity of the relative entropy considered here…

High Energy Physics - Theory · Physics 2025-10-28 Feng-Li Lin , Bo Ning

We pose the converse Madelung question: not whether Fisher information can reproduce quantum mechanics, but whether it is necessary. We work with minimal, physically motivated axioms on density and phase: locality, probability conservation,…

Quantum Physics · Physics 2025-11-17 Jonathan R Dunkley

Interacting particle systems in a finite-volume in equilibrium are often described by a grand-canonical ensemble induced by the corresponding Hamiltonian, i.e. a finite-volume Gibbs measure. However, in practice, directly measuring this…

Mathematical Physics · Physics 2024-07-30 Fabio Frommer

The initial-to-final-state inverse problem consists in determining a quantum Hamiltonian assuming the knowledge of the state of the system at some fixed time, for every initial state. We formulated this problem to establish a theoretical…

Analysis of PDEs · Mathematics 2025-12-05 Pedro Caro , Alberto Ruiz

The dynamics of a class of nonsymmetric gravitational theories is presented in Hamiltonian form. The derivation begins with the first-order action, treating the generalized connection coefficients as the canonical coordinates and the…

General Relativity and Quantum Cosmology · Physics 2009-10-28 M. A. Clayton

The inverse Kohn-Sham (KS) problem seeks a local effective potential whose noninteracting ground state reproduces a prescribed electron density. Existing inversion formulations are often expressed in disparate languages, including reduced…

Chemical Physics · Physics 2026-04-27 Nan Sheng
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