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We introduce an exactly solvable statistical-mechanical model of the hydration of non-polar compounds, based on grouping water molecules in clusters where hydrogen bonds and isotropic interactions occur; interactions between clusters are…

Statistical Mechanics · Physics 2009-11-07 Pierpaolo Bruscolini , Lapo Casetti

We report the first measurement of size-resolved photoelectron angular distributions for the valence orbitals of water clusters with up to 20 molecules. A systematic decrease of the photoelectron anisotropy is found for clusters with up to…

Chemical Physics · Physics 2017-03-17 Sebastian Hartweg , Bruce L. Yoder , Gustavo A. Garcia , Laurent Nahon , Ruth Signorell

A generalized Van der Waals approach is developed for anisotropic fluids in disordered porous media. As the reference system a hard spherocylinder fluid in a disordered porous medium is considered and described in the framework of the…

Soft Condensed Matter · Physics 2020-03-05 M. F. Holovko , V. I. Shmotolokha

We study the global hypoellipticity of the operator $\mathbb{L} = \mathrm{d}_t + \sum_{k=1}^m \omega_k \wedge \partial_{x_k}$, defined on differential forms over product manifolds of the form $M \times \mathbb{T}^m$, where $M$ is a…

Probabilistic Manifold Decomposition (PMD)\cite{doi:10.1137/25M1738863}, developed in our earlier work, provides a nonlinear model reduction by embedding high-dimensional dynamics onto low-dimensional probabilistic manifolds. The PMD has…

Numerical Analysis · Mathematics 2026-01-13 Jiaming Guo , Dunhui Xiao

A reduced model, which can fold both helix and sheet structures, is proposed to study the problem of protein folding. The goal of this model is to find an unbiased effective potential that has included the effects of water and at the same…

Soft Condensed Matter · Physics 2007-05-23 Nan-yow Chen

The particle proper orthogonal decomposition (PPOD) is demonstrated on cases of particle flows in decaying homogeneous isotropic turbulence. Data is generated through one-way coupled simulations, where particle positions and velocities are…

Fluid Dynamics · Physics 2022-05-30 Martin Schiødt , Azur Hodzic , Fabien Evrard , Berend van Wachem , Clara M. Velte

We present a strategy for the systematic extraction of a vast amount of detailed information on polarized parton densities and fragmentation functions from semi-inclusive deep inelastic scattering l+N -> l+h+X, in both LO and NLO QCD. A…

High Energy Physics - Phenomenology · Physics 2016-09-06 Ekaterina Christova , Elliot Leader

A non-local dynamic homogenization technique for the analysis of a viscoelastic heterogeneous material which displays a periodic microstructure is herein proposed. The asymptotic expansion of the micro-displacement field in the transformed…

Applied Physics · Physics 2018-11-26 Rosaria Del Toro , Andrea Bacigalupo , Marco Paggi

The orientational correlation scheme introduced earlier for tetrahedral molecules is extended for being able to classify orientational correlations between pairs of high symmetry molecules. While in the original algorithm a given…

Chemical Physics · Physics 2021-08-13 László Temleitner

Considering the flexibility and applicability of Bayesian modeling, in this work we revise the main characteristics of two hierarchical models in a regression setting. We study the full probabilistic structure of the models along with the…

Methodology · Statistics 2021-10-22 Juan Sosa , Jeimy Aristizabal

This paper presents a general, nonlinear isogeometric finite element formulation for rotation-free shells with embedded fibers that captures anisotropy in stretching, shearing, twisting and bending -- both in-plane and out-of-plane. These…

Computational Engineering, Finance, and Science · Computer Science 2023-06-06 Thang Xuan Duong , Mikhail Itskov , Roger Andrew Sauer

We discuss the topology of the parameter space of invertible phases with an onsite symmetry $G$, i.e., quantum many-body ground states that have neither fractionalization nor spontaneous breaking of the symmetry. The classification of…

Strongly Correlated Electrons · Physics 2024-09-17 Yuan Yao , Akira Furusaki

Recent studies have suggested a new phase in the extended Bose-Hubbard model in one dimension at integer filling [1,2]. In this work, we show that this new phase is phase-separated into a supersolid and superfluid part, generated by…

In this paper, we present finite-dimensional port-Hamiltonian system (PHS) models of a gas pipeline and a network comprising several pipelines for the purpose of control design and stability analysis. Starting from the partial differential…

Systems and Control · Electrical Eng. & Systems 2023-11-27 Albertus J. Malan , Lukas Rausche , Felix Strehle , Sören Hohmann

Soluble alpha-amylases play an important role in the catabolism of polysaccharides. In this work, we show that the enzyme can interact with the lipid membrane and further alter its mechanical properties. Vesicle fluctuation spectroscopy is…

Nucleic acids have been regarded as stiff polymers with long-range flexibility and generally modeled using elastic rod models of polymer physics. Notwithstanding, investigations carried out over the past few years on single fragments of…

Soft Condensed Matter · Physics 2025-05-09 Marco Zoli

We outline a strategy for quantitatively evaluating the conformational characteristics of self-assembled structures using the techniques of contrast variation small angle neutron scattering. By means of basis function expansion, a case…

Soft Condensed Matter · Physics 2021-10-27 Albert Y. Ho , Guan-Rong Huang , Wei-Ren Chen

We propose a model for a two dimensional, associative water-like lattice gas with one single variable representing both long and short-range interactions. The corresponding hamiltonian was solved exactly, by state enumeration in a finite…

Statistical Mechanics · Physics 2011-11-21 Marcelo R. Thielo , Marcia C. B. Barbosa

A non--singlet QCD analysis of the structure function $F_2(x,q^2)$ in LO, NLO, NNLO and N$^3$LO is performed based on the world data for charged lepton scattering. We determine the valence quark parton densities and present their…

High Energy Physics - Phenomenology · Physics 2016-09-06 Johannes Blümlein , Helmut Böttcher , Alberto Guffanti
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