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The behaviour of molecules in space is to a large extent governed by where they freeze out or sublimate. The molecular binding energy is thus an important parameter for many astrochemical studies. This parameter is usually determined with…

Astrophysics of Galaxies · Physics 2022-10-05 Torben Villadsen , Niels F. W. Ligterink , Mie Andersen

We present an information geometric analysis of entanglement generated by an s-wave scattering between two Gaussian wave packets. We conjecture that the pre and post-collisional quantum dynamical scenarios related to an elastic head-on…

Mathematical Physics · Physics 2015-05-20 D. -H. Kim , S. A. Ali , C. Cafaro , S. Mancini

Many modern data sets are sampled with error from complex high-dimensional surfaces. Methods such as tensor product splines or Gaussian processes are effective/well suited for characterizing a surface in two or three dimensions but may…

Machine Learning · Statistics 2017-06-16 Matthew W. Wheeler

Spherical symmetry is ubiquitous in nature. It's therefore unfortunate that spherical system simulations are so hard, and require complete spheres with millions of interacting particles. Here we introduce an approach to model spherical…

Materials Science · Physics 2011-10-07 Pekka Koskinen , Oleg O. Kit

Many processes in chemistry and physics take place on timescales that cannot be explored using standard molecular dynamics simulations. This renders the use of enhanced sampling mandatory. Here we introduce an enhanced sampling method that…

Chemical Physics · Physics 2020-06-12 Jayashrita Debnath , Michele Parrinello

We present an analytic model of thermal state-to-state rotationally inelastic collisions of polar molecules in electric fields. The model is based on the Fraunhofer scattering of matter waves and requires Legendre moments characterizing the…

Chemical Physics · Physics 2008-07-09 Mikhail Lemeshko , Bretislav Friedrich

An efficient technique to simulate turbulent particle-laden flow at high mass loadings within the four-way coupled simulation regime is presented. The technique implements large eddy simulation, discrete phase simulation, a deterministic…

Fluid Dynamics · Physics 2017-09-13 Derrick O. Njobuenwu , Michael Fairweather

A model in which a projectile like fragment can be simply regarded as a remnant after removal of some part of the projectile leads to an excited fragment. This excitation energy can be calculated with a Hamiltonian that gives correct…

Nuclear Theory · Physics 2015-06-15 S. Das Gupta , S. Mallik , G. Chaudhuri

The thermal model is commonly used in two different ways for the description of hadron production in ultra-relativistic heavy ion collision. One is the application of the thermal model to 4pi integrated data and the other is the thermal…

Nuclear Theory · Physics 2008-11-26 J. Sollfrank

A mesoscopic multi-particle collision model for fluid dynamics is generalized to incorporate the chemical reactions among species that may diffuse at different rates. This generalization provides a means to simulate reaction-diffusion…

Chemical Physics · Physics 2016-09-08 K. Tucci , R. Kapral

The physical foundations of the dissipation of energy and the associated heating in weakly collisional plasmas are poorly understood. Here, we compare and contrast several measures that have been used to characterize energy dissipation and…

Gaussian process is a theoretically appealing model for nonparametric analysis, but its computational cumbersomeness hinders its use in large scale and the existing reduced-rank solutions are usually heuristic. In this work, we propose a…

Machine Learning · Statistics 2015-11-25 Leo L. Duan , Xia Wang , Rhonda D. Szczesniak

We apply the Bayesian model selection method (based on the Bayes factor) to optimize $\sqrt{s_\mathrm{NN}}$-dependence in the phenomenological parameters of the (3+1)-dimensional hybrid framework for describing relativistic heavy-ion…

Nuclear Theory · Physics 2026-03-02 Syed Afrid Jahan , Hendrik Roch , Chun Shen

As a classical generative modeling approach, energy-based models have the natural advantage of flexibility in the form of the energy function. Recently, energy-based models have achieved great success in modeling high-dimensional data in…

Machine Learning · Computer Science 2024-01-19 Taoli Cheng , Aaron Courville

The Gaussian process (GP) regression model is a widely employed surrogate modeling technique for computer experiments, offering precise predictions and statistical inference for the computer simulators that generate experimental data.…

Methodology · Statistics 2024-04-02 Lulu Kang , Yuanxing Cheng , Yiwei Wang , Chun Liu

Within the framework of the Zakharov-Schulman approach, in close analogy with the methods of quantum field theory, the classical scattering matrix for the simplest process of interaction between hard and soft excitations in a quark-gluon…

High Energy Physics - Theory · Physics 2025-11-10 Yu. A. Markov , M. A. Markova , D. M. Gitman , N. Yu. Markov

Recent years have seen a huge development in spatial modelling and prediction methodology, driven by the increased availability of remote-sensing data and the reduced cost of distributed-processing technology. It is well known that…

Computation · Statistics 2020-02-18 Andrew Zammit-Mangion , Jonathan Rougier

The current status of various thermal and statistical descriptions of particle production in the ultra-relativistic heavy-ion collisions experiments is presented in detail. We discuss the formulation of various types of thermal models of a…

High Energy Physics - Phenomenology · Physics 2017-01-06 S. K. Tiwari , C. P. Singh

The study of symmetry plane correlations (SPCs) can be useful in characterizing the direction of the anisotropic emission of produced particles in the final state. The study of SPCs provides an independent method to understand the transport…

Nuclear Experiment · Physics 2025-12-09 Sarthak Tripathy , Suraj Prasad , Raghunath Sahoo

Gaussian Process (GP) models provide a flexible framework for prediction and uncertainty quantification. For most covariance functions, however, exact GP prediction with $n$ points scales as $\mathcal{O}(n^3)$, making it prohibitively…

Computation · Statistics 2026-05-29 Samanyu Arora , Christopher J. Geoga