Topic: computational-physics Goto Github

👇 Here are 581 public repositories matching this topic...

alexpapados / physics-informed-deep-learning-solid-and-fluid-mechanics
computational-physics,Using Physics-Informed Deep Learning (PIDL) techniques (W-PINNs-DE & W-PINNs) to solve forward and inverse hydrodynamic shock-tube problems and plane stress linear elasticity boundary value problems
User: alexpapados
pinns computational-fluid-dynamics computational-physics physics-informed-neural-networks physics-based-simulation linear-elasticity hydrodynamics shock-tube

arm61 / pylj
computational-physics,Teaching Utility for Classical Atomistic Simulation.
User: arm61
Home Page: https://pythoninchemistry.org/pylj
chemistry computational-chemistry computational-physics education jupyter-notebook molecular-dynamics monte-carlo physics

aromanro / hartreefock
computational-physics,A program implementing the Hartree–Fock (also post-HF: MP2, CCSD(T), CIS and TDHF/RPA)/self-consistent field method (also DIIS) with Gaussian orbitals
User: aromanro
Home Page: https://compphys.go.ro/the-hartree-fock-program/
physics computational-physics hartree-fock atom molecule orbital gaussian eigen self-constent-field mfc

aromanro / isingmontecarlo
computational-physics,A program implementing Metropolis Monte Carlo for the 2D square-lattice Ising model and the spin block renormalization
User: aromanro
Home Page: https://compphys.go.ro/metropolis-for-2d-ising-and-spin-block-renormalization/
physics computational-physics ising-model ising-model-2d spin phase-transition metropolis-monte-carlo mfc

aromanro / latticeboltzmann
computational-physics,A 2D Lattice Boltzmann program
User: aromanro
Home Page: https://compphys.go.ro/lattice-boltzmann/
computational-fluid-dynamics computational-fluid-simulation computational-physics fluid-dynamics fluid-simulation lattice-boltzmann mfc physics physics-simulation

aromanro / pythoncompphys
computational-physics,Some python workbooks with various topics from Computational Physics
User: aromanro
computational-physics python python3 numpy matplotlib scipy computational-chemistry computational-science density-functional-theory hartree-fock hartree-fock-methods carr-parrinello physics jupyter-notebook quantum-mechanics quantum

aromanro / qcsim
computational-physics,Quantum computing simulator
User: aromanro
computational-physics physics physics-simulation quantum quantum-computing quantum-algorithms quantum-computing-algorithms quantum-information simulation simulator

aromanro / solarsystem
computational-physics,A solar system simulator with Verlet, using OpenGL for displaying.
User: aromanro
Home Page: https://compphys.go.ro/newtonian-gravity/
physics computational-physics physics-simulation solarsystem planet moon solar opengl glm lightning

atomicarchitects / equiformer_v2
computational-physics,[ICLR'24] EquiformerV2: Improved Equivariant Transformer for Scaling to Higher-Degree Representations
Organization: atomicarchitects
Home Page: https://arxiv.org/abs/2306.12059
catalyst-design computational-chemistry computational-physics deep-learning drug-discovery equivariant-graph-neural-network equivariant-neural-networks force-fields interatomic-potentials machine-learning

awietek / ed_basics
computational-physics,Basics on Exact Diagonalization
User: awietek
computational-physics exact-diagonalization

beliavsky / fortran-related-books
computational-physics,Books with Fortran code, other than textbooks
User: beliavsky
fortran numerical-methods finite-elements cfd computational-physics books book-list

boutproject / bout-dev
computational-physics,BOUT++: Plasma fluid finite-difference simulation code in curvilinear coordinate systems
Organization: boutproject
Home Page: http://boutproject.github.io/
plasma physics pde numerical-modelling physics-simulation-library computational-physics c-plus-plus python

by256 / icsg3d
computational-physics,3-D Inorganic Crystal Structure Generation and Property Prediction via Representation Learning (JCIM 2020)
User: by256
Home Page: https://pubs.acs.org/doi/10.1021/acs.jcim.0c00464
computational-physics computational-chemistry cheminformatics representation-learning deep-learning crystallography

celeritas-project / celeritas
computational-physics,Celeritas is a new Monte Carlo transport code designed to accelerate scientific discovery in high energy physics by improving detector simulation throughput and energy efficiency using GPUs.
Organization: celeritas-project
Home Page: https://celeritas-project.github.io/celeritas/user/index.html
hep cuda computational-physics monte-carlo detector-simulation particle-transport

cubbyflow / cubbyflow
computational-physics,Voxel-based fluid simulation engine for computer games
Organization: cubbyflow
Home Page: https://cubbyflow.github.io/CubbyFlow/
physics-engine fluid-simulation-engine computer-graphics computational-physics computational-fluid-dynamics cpp cpp17 cplusplus

developer-y / cs-video-courses
computational-physics,List of Computer Science courses with video lectures.
User: developer-y
computer-science algorithms systems databases machine-learning web-development security computer-architecture bioinformatics robotics

diffqc / dqc
computational-physics,Differentiable Quantum Chemistry (only Differentiable Density Functional Theory and Hartree Fock at the moment)
Organization: diffqc
Home Page: https://dqc.readthedocs.io/
quantum-chemistry density-functional-theory automatic-differentiation computational-chemistry computational-physics hartree-fock

doyubkim / fluid-engine-dev
computational-physics,Fluid simulation engine for computer graphics applications
User: doyubkim
Home Page: https://fluidenginedevelopment.org/
physics-engine fluid-simulation-engine computer-graphics computational-physics animation c-plus-plus computational-fluid-dynamics

dylanljones / lattpy
computational-physics,Simple and efficient Python package for modeling d-dimensional Bravais lattices in solid state physics.
User: dylanljones
Home Page: https://lattpy.readthedocs.io/en/stable/
bravais bravais-lattice computational-physics crystal high-dimensional lattice nearest-neighbors neighbors physics python solid-state-physics

evalf / nutils
computational-physics,The nutils project
Organization: evalf
Home Page: http://www.nutils.org/
finite-elements python nutils simulation-framework computational-physics scientific-computing

exadg / exadg
computational-physics,ExaDG - High-Order Discontinuous Galerkin for the Exa-Scale
Organization: exadg
fluid-dynamics cfd exa-scale simulation turbulence discontinuous-galerkin discontinuous-galerkin-method multigrid computational-fluid-dynamics computational-physics

felixdesrochers / numerov
computational-physics,A python script that solves the one dimensional time-independent Schrodinger equation for bound states. The script uses a Numerov method to solve the differential equation and displays the desired energy levels and a figure with an approximate wave function for each of these energy levels.
User: felixdesrochers
computational-physics numerov-cooley-algorithm python quantum-mechanics schrodinger-equation

feltor-dev / feltor
computational-physics,Numerical methods for edge and scrape-off layer blob and turbulence simulations. Homepage:
Organization: feltor-dev
Home Page: http://feltor-dev.github.io
discontinuous-galerkin gpu openmp computational-physics computational-fluid-dynamics numerical-simulations plasma-turbulence cuda c-plus-plus numerical-methods

geant4 / geant4
computational-physics,Geant4 toolkit for the simulation of the passage of particles through matter - NIM A 506 (2003) 250-303
Organization: geant4
Home Page: https://geant4.org
monte-carlo-simulation particle-transport computational-physics high-energy-physics high-performance-computing medical-physics neutron-transport nuclear-data photon-transport radiation-transport

glotzerlab / freud
computational-physics,Powerful, efficient particle trajectory analysis in scientific Python.
Organization: glotzerlab
Home Page: https://freud.readthedocs.io
molecular-dynamics analysis scientific-computing python monte-carlo-simulation data-analysis spatial-analysis particle-system computational-chemistry computational-physics

gregwinther / youtube
computational-physics,Examples used in youtube videos
User: gregwinther
Home Page: https://www.youtube.com/channel/UCnjX4ZR_aom8P3UOjU3Qkbg
computational-physics tutorials youtube-videos

isosnovik / top
computational-physics,Dataset of topology optimization
User: isosnovik
topy mbb dataset computational-physics finite-element-analysis python python-3 topology-optimization

manu-mannattil / nolitsa
computational-physics,A Python module implementing some standard algorithms used in nonlinear time series analysis
User: manu-mannattil
chaos computational-physics nonlinear-dynamics python time-series-analysis

matersim / computationalphysics300
computational-physics,computational physics class taught at UNLV (Phys300)
Organization: matersim
computational-physics machine-learning python

michellab / biosimspace
computational-physics,Code and resources for the EPSRC BioSimSpace project.
Organization: michellab
Home Page: https://biosimspace.org
biomolecular-simulation interoperability ccpbiosim computational-chemistry computational-physics computational-biology molecular-dynamics reproducibility reproducible-research

mohuangrui / artracfd
computational-physics,ArtraCFD: A Computational Fluid Dynamics Solver
User: mohuangrui
computational-fluid-dynamics computational-geometry computational-mathematics computational-physics

openbiosim / biosimspace
computational-physics,An interoperable Python framework for biomolecular simulation.
Organization: openbiosim
Home Page: https://biosimspace.openbiosim.org
computational-biology computational-chemistry computational-physics drug-discovery interoperability molecular-dynamics reproducibility reproducible-research molecular-simulation biomolecular-simulation

openmc-dev / openmc
computational-physics,OpenMC Monte Carlo Code
Organization: openmc-dev
Home Page: https://docs.openmc.org
monte-carlo-simulation particle-transport nuclear-engineering nuclear-energy nuclear-fusion openmc neutronics photon-transport neutron-transport radiation-transport

pharehub / phare
computational-physics,💫 Parallel Hybrid Particle In Cell code with Adaptive mesh REfinement
Organization: pharehub
Home Page: https://phare.readthedocs.io
particle-in-cell plasma-physics research hybrid lpp hpc numerical-simulations simulation physics c-plus-plus-17 computational-physics

photon-ai-research / neuralsolvers
computational-physics,Neural network based solvers for partial differential equations and inverse problems :milky_way:. Implementation of physics-informed neural networks in pytorch.
Organization: photon-ai-research
pinn horovod partial-differential-equations neural-network computational-physics pytorch

rabauke / trng4
computational-physics,state of the art C++ pseudo-random number generator library for sequential and parallel Monte Carlo simulations
User: rabauke
Home Page: https://www.numbercrunch.de/trng/
c-plus-plus computational-finance computational-physics hpc library monte-carlo-methods pseudo-random-generator

rajeshrinet / compphy
computational-physics,Assortment of code for model systems in computational physics
User: rajeshrinet
Home Page: https://github.com/rajeshrinet/compPhy
ising-model tasep computational-physics monte-carlo-simulations python exclusion-processes

rmeli / hartree-fock
computational-physics,Solution of Hartree-Fock equations within Pople's STO-3G basis set
User: rmeli
hartree-fock quantum-chemistry quantum-mechanics basis-set computational-physics computational-chemistry

santoshkumarradha / pysktb
computational-physics,Scientific Python package for solving Slater Koster tight-binding topological hamiltonian
User: santoshkumarradha
Home Page: https://pysktb.readthedocs.io/
topology condensed physics slater-koster tight-binding hamiltonian electronic-structure band-structure topological-insulator python

smutao / pyvibms
computational-physics,A PyMOL plugin for visualizing vibrations in molecules and solids
User: smutao
Home Page: https://sites.smu.edu/dedman/catco/publications/pdf/434.pdf
pymol-plugin vibrational-spectroscopy quantum-chemistry theoretical-chemistry computational-physics pymol computational-chemistry

sthavishtha / list-lattice-boltzmann-codes
computational-physics,Curated list of some open source codes employing lattice Boltzmann methods
User: sthavishtha
lattice-boltzmann lbm multiphase-flow turbulence particles thermal microflow porous-media-flow mesh-refinement shallow-water-equations parallel-numerical-framework multiphase-flows thermal-flows computational-science scientific-computing hpc-applications computational-physics fluid-simulation computational-fluid-dynamics

sthavishtha / turbulence-codes
computational-physics,Curated list of some open-source codes for turbulent flow simulations, including turbulent multiphase, turbulent reacting flows, turbulent convection and turbulent atmospheric physics.
User: sthavishtha
open-source turbulence turbulence-models compressible-flows low-mach cfd navier-stokes hpc fluid-dynamics computational-fluid-dynamics

tempocollaboration / oqupy
computational-physics,A Python package to efficiently simulate non-Markovian open quantum systems with process tensors.
Organization: tempocollaboration
Home Page: https://oqupy.readthedocs.io
computational-physics many-body-physics open-quantum-systems physics python python3-package quantum-information quantum-physics

theochem / iodata
computational-physics,Python library for reading, writing, and converting computational chemistry file formats and generating input files.
Organization: theochem
Home Page: https://iodata.readthedocs.io/
quantum-chemistry quantum-chemistry-programs quantum-chemistry-packages computational-chemistry computational-biology computational-physics file-format-converter data-parsing json-schema theoretical-chemistry

utilforever / cubbyflow-v1
computational-physics,Voxel-based fluid simulation engine for computer games
User: utilforever
Home Page: http://utilforever.github.io/CubbyFlow-v1
physics-engine fluid-simulation-engine computer-graphics computational-physics c-plus-plus computational-fluid-dynamics voxel-based

vinhphunguyen / how-to-write-a-paper
computational-physics,How to write a high quality scientific article using LaTeX. Source code included.
User: vinhphunguyen
scientific-writing latex computational-physics

vlvovch / phys6350-computationalphysics
computational-physics,Lecture notes and code for the course PHYS6350 Computational Physics at the University of Houston
User: vlvovch
computational-physics numerical-methods physics-simulation

votca / xtp
computational-physics,GW-BSE for excited state Quantum Chemistry in a Gaussian Orbital basis, electronic spectroscopy with QM/MM, charge and energy dynamics in complex molecular systems
Organization: votca
quantum-chemistry gw-bse quantum-classical excited-states multiscale-simulation computational-physics computational-chemistry

wonmor / electronvisualized
computational-physics,Public Archive: Beautiful and Elegant Quantum Mechanics Visualization.
User: wonmor
Home Page: https://electronvisual.org
math mathematical-modelling mathematics physics physics-analysis physics-engine physics-simulation python python3 flask flask-api react reactjs chemistry computational-chemistry computational-physics electron visualization quantum-mechanics

zaman13 / double-pendulum-motion-animation
computational-physics,Animation of the motion a double-pendulum. Both Julia and Python versions of the code are given.
User: zaman13
animation julia python pendulum double-pendulum chaotic-dynamical-systems chaotic-motion differential-equations computational-physics numerical-methods