Alternatives and similar repositories for BDpack

Users that are interested in BDpack are comparing it to the libraries listed below

• usnistgov / iprPy
  NIST Interatomic Potential Repository property calculation tools
  ☆24Updated last month
• edwardsmith999 / TTCF4LAMMPS
  ☆12Updated last month
• openiec / openiec
  OpenIEC: An open-source code for interfacial energy calculation in alloys
  ☆36Updated last year
• usnistgov / feasst
  The Free Energy and Advanced Sampling Simulation Toolkit (FEASST) is a free and open-source software to conduct molecular- and particle-b…
  ☆42Updated last week
• idaholab / SPPARKS
  Kinetic Monte Carlo Simulator
  ☆30Updated 4 years ago
• PhasesResearchLab / ESPEI
  Fitting thermodynamic models with pycalphad - https://doi.org/10.1557/mrc.2019.59
  ☆73Updated this week
• atoms-ufrj / postlammps
  A tool for performing post-processing of lammps log files
  ☆13Updated 4 years ago
• Atomistica / atomistica
  Atomistica is a library of interatomic potentials that is compatible with ASE and LAMMPS
  ☆88Updated 2 months ago
• mosdef-hub / mbuild_tutorials
  A set of tutorials to introduce new users to mBuild
  ☆11Updated 4 years ago
• tilde-lab / tilde
  Materials informatics framework for ab initio data repositories
  ☆18Updated 3 years ago
• diffpy / diffpy.structure
  Crystal structure container and parsers for structure formats.
  ☆35Updated last month
• abinit / pseudo_dojo
  Python framework for generating and validating pseudo potentials
  ☆45Updated last year
• thynnine / pysic
  Python library for advanced atomistic simulations
  ☆23Updated 7 years ago
• usnistgov / atomman
  Atomistic Manipulation Toolkit
  ☆90Updated last month
• lmhale99 / atomman
  Atomistic Manipulation Toolkit
  ☆36Updated last week
• DallasTrinkle / Onsager
  Onsager coefficients for interstitial and vacancy-mediated diffusion
  ☆13Updated 7 months ago
• GOMC-WSU / GOMC
  GOMC - GPU Optimized Monte Carlo is a parallel molecular simulation code designed for high-performance simulation of large systems
  ☆84Updated this week
• palmergroup / hmcwithlammps
  ☆14Updated 6 years ago
• evenmn / lammps-bulk-benchmark
  Benchmark CPUs and GPUs by running molecular dynamics simulations in LAMMPS
  ☆15Updated 2 years ago
• alesgenova / pbcpy
  Python package providing some useful tools when dealing with molecules and materials under periodic boundary conditions and uniform grids…
  ☆19Updated 4 years ago
• atoms-ufrj / playmol
  Playmol is a(nother) software for building molecular models
  ☆19Updated 2 years ago
• times-software / feff10
  ☆27Updated last month
• nuwan-d / polymer_metal_interface
  Provides some useful information and the LAMMPS input files to model a polymer-metal interface.
  ☆38Updated 3 years ago
• wolverton-research-group / periodic-table-plotter
  Make periodic table map plots and pettifor-style trend plots.
  ☆28Updated 7 years ago
• uw-cmg / MAST
  MAterials Simulation Toolkit for use with pymatgen
  ☆17Updated last year
• mpds-io / mpds-api
  Tutorials, notebooks, issue tracker, and website on the MPDS API: the data retrieval interface for the Materials Platform for Data Scienc…
  ☆26Updated this week
• materialsvirtuallab / nano106
  Course materials for NANO 106 - Crystallography of Materials
  ☆35Updated 3 years ago
• chrisjsewell / ipymd
  Analysis of Molecular Dynamics output in the IPython Notebook
  ☆10Updated 8 years ago
• lanl / LATTE
  Developer repository for the LATTE code
  ☆46Updated 4 months ago
• JQFonseca / computing_materials_science
  Jupyter notebooks for the Computing and Comunication skills 1st Year Materials Science Course at Manchester
  ☆46Updated last year