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We present a path integral Monte Carlo method which is the full quantum analogue of the Gibbs ensemble Monte Carlo method of Panagiotopoulos to study the gas-liquid coexistence line of a classical fluid. Unlike previous extensions of Gibbs…

Materials Science · Physics 2014-09-22 Riccardo Fantoni , Saverio Moroni

Models of non-interacting fermions coupled to auxilliary classical degrees of freedom are relevant to the understanding of a wide variety of problems in many body physics, {\it e.g.} the description of manganites, diluted magnetic…

Statistical Mechanics · Physics 2016-06-29 Przemysław R. Grzybowski , Łukasz Czekaj , Mariusz Nogala , Adam Ścibior , Ravindra W. Chhajlany

Theoretical predictions in high energy physics are routinely provided in the form of Monte Carlo generators. Comparisons of predictions from different programs and/or different initialization set-ups are often necessary. MC-TESTER can be…

High Energy Physics - Phenomenology · Physics 2011-01-17 N. Davidson , P. Golonka , T. Przedzinski , Z. Was

The auxiliary-field quantum Monte Carlo (AFQMC) method provides a computational framework for solving the time-independent Schroedinger equation in atoms, molecules, solids, and a variety of model systems. AFQMC has recently witnessed…

Computational Physics · Physics 2018-08-14 Mario Motta , Shiwei Zhang

PyMembrane is a software package for simulating liquid and elastic membranes using a discretisation of the continuum description based on unstructured triangulated two-dimensional meshes embedded in three-dimensional space. The package is…

Soft Condensed Matter · Physics 2023-08-25 D. A. Matoz-Fernandez , Siyu Li , Monica Olvera de la Cruz , Rastko Sknepnek

A Monte Carlo framework, MaGe, has been developed based on the Geant4 simulation toolkit. Its purpose is to simulate physics processes in low-energy and low-background radiation detectors, specifically for the Majorana and Gerda $^{76}$Ge…

In this proceedings we present MadFlow, a new framework for the automation of Monte Carlo (MC) simulation on graphics processing units (GPU) for particle physics processes. In order to automate MC simulation for a generic number of…

Computational Physics · Physics 2021-09-08 Stefano Carrazza , Juan Cruz-Martinez , Marco Rossi , Marco Zaro

Quantum Monte Carlo (QMC) is an advanced simulation methodology for studies of manybody quantum systems. In this review, we focus on the electronic structure QMC, i.e., methods relevant for systems described by the electron-ion…

Other Condensed Matter · Physics 2010-08-16 Michal Bajdich , Lubos Mitas

In low-temperature high-density plasmas quantum effects of the electrons are becoming increasingly important. This requires the development of new theoretical and computational tools. Quantum Monte Carlo methods are among the most…

Statistical Mechanics · Physics 2014-08-12 T. Schoof , S. Groth , M. Bonitz

The Simulation Environment for Atomistic and Molecular Modeling (SEAMM) is an open-source software package written in Python that provides a graphical interface for setting up, executing, and analyzing molecular and materials simulations.…

CAELinux is a Linux distribution which is bundled with free software packages related to Computer Aided Engineering (CAE). The free software packages include software that can build a three dimensional solid model, programs that can mesh a…

Mathematical Software · Computer Science 2012-12-19 Kirana Kumara P.

A novel method for simulating the statistical mechanics of molecular systems in which both nuclear and electronic degrees of freedom are treated quantum mechanically is presented. The scheme combines a path integral description of the…

Computational Physics · Physics 2009-10-31 Ruben O. Weht , Jorge Kohanoff , Dario A. Estrin , Charusita Chakravarty

The open-source and community-supported gem5 simulator is one of the most popular tools for computer architecture research. This simulation infrastructure allows researchers to model modern computer hardware at the cycle level, and it has…

RUMD is a general purpose, high-performance molecular dynamics (MD) simulation package running on graphical processing units (GPU's). RUMD addresses the challenge of utilizing the many-core nature of modern GPU hardware when simulating…

Being motivated by the surge of fermionic quantum Monte Carlo simulations at finite temperature, we present a detailed analysis of the permutation-cycle properties of path integral Monte Carlo (PIMC) simulations of degenerate electrons.…

Computational Physics · Physics 2019-07-24 Tobias Dornheim , Simon Groth , Alexei Filinov , Michael Bonitz

MCgrid is a software package that provides access to the APPLgrid interpolation tool for Monte Carlo event generator codes, allowing for fast and flexible variations of scales, coupling parameters and PDFs in cutting edge leading and…

High Energy Physics - Phenomenology · Physics 2016-11-25 Luigi Del Debbio , Nathan P. Hartland , Steffen Schumann

Monte Carlo simulations are performed to study the in-plane transport of spin-polarized electrons in III-V semiconductor quantum wells. The density matrix description of the spin polarization is incorporated in the simulation algorithm. The…

Mesoscale and Nanoscale Physics · Physics 2010-09-22 Min Shen , Semion Saikin , Ming-C. Cheng , Vladimir Privman

The ergm package supports the statistical analysis and simulation of network data. It anchors the statnet suite of packages for network analysis in R introduced in a special issue in Journal of Statistical Software in 2008. This article…

Computation · Statistics 2022-03-17 Pavel N. Krivitsky , David R. Hunter , Martina Morris , Chad Klumb

This monograph presents advancements in Airborne Gamma-Ray Spectrometry (AGRS), a critical tool for emergency response to radiological incidents such as severe nuclear accidents or nuclear weapon detonations. Current AGRS calibration and…

Instrumentation and Detectors · Physics 2025-04-16 David Breitenmoser

This extended abstract briefly summarizes ongoing research activity on the evaluation and experimental validation of physics methods for photon and electron transport. The analysis includes physics models currently implemented in Geant4 as…

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