Computational Physics

Authors and titles for physics.comp-ph in Nov 2022, skipping first 75

[76]  arXiv:2211.11728 (cross-list from physics.flu-dyn) [pdf, other]

Title: A Review on Contact and Collision Methods for Multi-body Hydrodynamic problems in Complex Flows

Authors: Sajjad Karimnejad, Amin Amiri Delouei, Hakan Basagaoglu, Mohsen Nazari, Mohammad Mohsen Shahmardan, Giacomo Falcucci, Marco Lauricella, Sauro Succi

Comments: 37 pages, 12 Figures

Journal-ref: Commun. Comput. Phys., 32 (2022), pp. 899-950

Subjects: Fluid Dynamics (physics.flu-dyn); Computational Physics (physics.comp-ph)

[77]  arXiv:2211.12010 (cross-list from physics.chem-ph) [pdf, other]

Title: Enhancement of parity-violating energy difference of CHFClBr, CHFClI, and CHFBrI by breaking the cancellation among valence orbital contributions

Authors: Naoya Kuroda, Ayaki Sunaga, Masato Senami

Comments: Some typos are fixed

Subjects: Chemical Physics (physics.chem-ph); Atomic and Molecular Clusters (physics.atm-clus); Computational Physics (physics.comp-ph); Quantum Physics (quant-ph)

[78]  arXiv:2211.12163 (cross-list from physics.flu-dyn) [pdf, other]

Title: Bifurcation analysis of a two-dimensional magnetic Rayleigh-Bénard problem

Authors: Fabian Laakmann, Nicolas Boullé

Comments: 14 pages, 7 figures

Subjects: Fluid Dynamics (physics.flu-dyn); Numerical Analysis (math.NA); Computational Physics (physics.comp-ph)

[79]  arXiv:2211.12248 (cross-list from physics.optics) [pdf, ps, other]

Title: Hopfield-like open channel retrieval for disordered optical media

Authors: Marco Leonetti, Luca Leuzzi, Giancarlo Ruocco

Comments: 6 pages, 5 figures

Subjects: Optics (physics.optics); Disordered Systems and Neural Networks (cond-mat.dis-nn); Computational Physics (physics.comp-ph)

[80]  arXiv:2211.12362 (cross-list from physics.plasm-ph) [pdf, other]

Title: Revisiting Kinematic Fast Dynamo in 3-dimensional magnetohydrodynamic plasmas: Dynamo transition from non-Helical to Helical flows

Authors: Shishir Biswas, Rajaraman Ganesh

Subjects: Plasma Physics (physics.plasm-ph); Astrophysics of Galaxies (astro-ph.GA); Computational Physics (physics.comp-ph); Fluid Dynamics (physics.flu-dyn)

[81]  arXiv:2211.12922 (cross-list from physics.flu-dyn) [pdf, other]

Title: Unified gas-kinetic wave-particle methods VII: diatomic gas with rotational and vibrational nonequilibrium

Authors: Yufeng Wei, Yajun Zhu, Kun Xu

Subjects: Fluid Dynamics (physics.flu-dyn); Computational Physics (physics.comp-ph)

[82]  arXiv:2211.13672 (cross-list from physics.chem-ph) [pdf, other]

Title: A Self-Attention Ansatz for Ab-initio Quantum Chemistry

Authors: Ingrid von Glehn, James S. Spencer, David Pfau

Subjects: Chemical Physics (physics.chem-ph); Machine Learning (cs.LG); Computational Physics (physics.comp-ph)

[83]  arXiv:2211.14071 (cross-list from physics.med-ph) [pdf, other]

Title: Simulation of Particle Release for Diffusing Alpha-Emitters Radiation Therapy

Authors: Dmytro Fedorchenko, Shlomi Alani

Subjects: Medical Physics (physics.med-ph); Computational Physics (physics.comp-ph)

[84]  arXiv:2211.14392 (cross-list from physics.chem-ph) [pdf, other]

Title: Ultra-Fast Semi-Empirical Quantum Chemistry for High-Throughput Computational Campaigns with Sparrow

Authors: Francesco Bosia, Peikun Zheng, Alain Vaucher, Thomas Weymuth, Pavlo O. Dral, Markus Reiher

Comments: 39 pages, 4 figures, 4 tables

Journal-ref: J. Chem. Phys. 158, 054118 (2023)

Subjects: Chemical Physics (physics.chem-ph); Computational Physics (physics.comp-ph)

[85]  arXiv:2211.14688 (cross-list from physics.chem-ph) [pdf, other]

Title: High-throughput ab initio reaction mechanism exploration in the cloud with automated multi-reference validation

Authors: Jan P. Unsleber, Hongbin Liu, Leopold Talirz, Thomas Weymuth, Maximilian Mörchen, Adam Grofe, Dave Wecker, Christopher J. Stein, Ajay Panyala, Bo Peng, Karol Kowalski, Matthias Troyer, Markus Reiher

Comments: 30 pages, 11 figures

Journal-ref: J. Chem. Phys. 158, 084803 (2023)

Subjects: Chemical Physics (physics.chem-ph); Materials Science (cond-mat.mtrl-sci); Computational Physics (physics.comp-ph)

[86]  arXiv:2211.15126 (cross-list from physics.atom-ph) [pdf, ps, other]

Title: Nondipole signatures in ionization

Authors: M. C. Suster, J. Derlikiewicz, K. Krajewska, F. Cajiao Vélez, J. Z. Kamiński

Comments: 9 figures

Subjects: Atomic Physics (physics.atom-ph); Computational Physics (physics.comp-ph); Optics (physics.optics); Plasma Physics (physics.plasm-ph)

[87]  arXiv:2211.15629 (cross-list from physics.chem-ph) [pdf, other]

Title: Analysis and Optimization of Resonance Energies and Widths Using Complex Absorbing Potentials

Authors: Jerryman A. Gyamfi, Thomas -C. Jagau

Comments: 13 pages, 8 figures

Subjects: Chemical Physics (physics.chem-ph); Atomic and Molecular Clusters (physics.atm-clus); Biological Physics (physics.bio-ph); Computational Physics (physics.comp-ph)

[88]  arXiv:2211.15756 (cross-list from physics.flu-dyn) [pdf, other]

Title: Computational Analysis of Bubble-Structure Interactions in Near-Field Underwater Explosion

Authors: Wentao Ma, Xuning Zhao, Christine Gilbert, Kevin Wang

Journal-ref: International Journal of Solids and Structures 242 (2022) 111527

Subjects: Fluid Dynamics (physics.flu-dyn); Applied Physics (physics.app-ph); Computational Physics (physics.comp-ph)

[89]  arXiv:2211.15812 (cross-list from physics.chem-ph) [pdf, other]

Title: EMReact: A Tool for Modelling Electromagnetic Field Induced Effects in Chemical Reactions by Solving the Discrete Stochastic Master Equation

Authors: Kelvin Dsouza, Daryoosh Vashaee

Subjects: Chemical Physics (physics.chem-ph); Computational Physics (physics.comp-ph)

[90]  arXiv:2211.15814 (cross-list from physics.flu-dyn) [pdf, other]

Title: A Cartesian-octree adaptive front-tracking solver for immersed biological capsules in large complex domains

Authors: Damien P. Huet, Anthony Wachs

Comments: 42 pages, 18 figures

Subjects: Fluid Dynamics (physics.flu-dyn); Computational Physics (physics.comp-ph)

[91]  arXiv:2211.16427 (cross-list from physics.flu-dyn) [pdf, ps, other]

Title: Multi-agent reinforcement learning for wall modeling in LES of flow over periodic hills

Authors: Di Zhou, Michael P. Whitmore, Kevin P. Griffin, H. Jane Bae

Subjects: Fluid Dynamics (physics.flu-dyn); Machine Learning (cs.LG); Computational Physics (physics.comp-ph)

[92]  arXiv:2211.16560 (cross-list from physics.optics) [pdf, other]

Title: Automated Discovery and Optimization of 3D Topological Photonic Crystals

Authors: Samuel Kim, Thomas Christensen, Steven G. Johnson, Marin Soljačić

Comments: 14 pages, 7 figures

Subjects: Optics (physics.optics); Other Condensed Matter (cond-mat.other); Computational Physics (physics.comp-ph)

[93]  arXiv:2211.16567 (cross-list from physics.flu-dyn) [pdf, ps, other]

Title: Inverse cascade of gravity waves in the presence of condensate: numerical simulation

Authors: Alexander O. Korotkevich (Department of Mathematics and Statistics, University of New Mexico, New Mexico, USA, Landau Institute for Theoretical Physics RAS, Moscow region, Russia)

Comments: 9 pages, 2 figures, 1 table

Subjects: Fluid Dynamics (physics.flu-dyn); Computational Physics (physics.comp-ph)

[94]  arXiv:2211.16604 (cross-list from physics.plasm-ph) [pdf, ps, other]

Title: Verification of the generalized reduced-order particle-in-cell scheme in a radial-azimuthal ExB plasma configuration

Authors: Farbod Faraji, Maryam Reza, Aaron Knoll

Comments: 17 pages, 15 figures. This article has been submitted to the journal of Physics of Plasmas

Subjects: Plasma Physics (physics.plasm-ph); Computational Physics (physics.comp-ph)

[95]  arXiv:2211.16763 (cross-list from physics.chem-ph) [pdf, other]

Title: Inverse molecular design and parameter optimization with Hückel theory using automatic differentiation

Authors: R. A. Vargas-Hernández, K. Jorner, R. Pollice, A. Aspuru-Guzik

Comments: 31 pages, 16 Figures

Subjects: Chemical Physics (physics.chem-ph); Computational Physics (physics.comp-ph)

[96]  arXiv:2211.16933 (cross-list from physics.flu-dyn) [pdf, other]

Title: Quadrature-based Lattice Boltzmann model for non-equilibrium dense gas flows

Authors: S. Busuioc

Comments: 16 pages, 8 figures

Subjects: Fluid Dynamics (physics.flu-dyn); Computational Physics (physics.comp-ph)

[97]  arXiv:2211.00214 (cross-list from cs.LG) [pdf, other]

Title: Transfer Learning with Physics-Informed Neural Networks for Efficient Simulation of Branched Flows

Authors: Raphaël Pellegrin, Blake Bullwinkel, Marios Mattheakis, Pavlos Protopapas

Comments: 5 pages, 3 figures

Subjects: Machine Learning (cs.LG); Computational Physics (physics.comp-ph)

[98]  arXiv:2211.00244 (cross-list from cond-mat.str-el) [pdf, other]

Title: Nonlocal optical conductivity of Fermi surface nesting materials

Authors: Xiamin Huang, Xiao Jiang, Bing Huang, Zhou Li

Comments: 16 pages, 12 figures, to appear on Science China Physics, Mechanics & Astronomy

Subjects: Strongly Correlated Electrons (cond-mat.str-el); Computational Physics (physics.comp-ph)

[99]  arXiv:2211.00341 (cross-list from cond-mat.mtrl-sci) [pdf, other]

Title: Decoherence analysis of silicon vacancies in 3C-SiC

Authors: Tommaso Fazio, Giuseppe Fisicaro, Ioannis Deretzis, Elisabetta Paladino, Antonino La Magna

Comments: 36 pages, 10 figures, 3 tables

Subjects: Materials Science (cond-mat.mtrl-sci); Computational Physics (physics.comp-ph)

[100]  arXiv:2211.00720 (cross-list from cs.DC) [pdf, other]

Title: Apple Silicon Performance in Scientific Computing

Authors: Connor Kenyon, Collin Capano

Comments: 10 pages, 3 figures, IEEE HPEC

Subjects: Distributed, Parallel, and Cluster Computing (cs.DC); Computational Physics (physics.comp-ph)