Alternatives and similar repositories for aces

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

• nakib / elphbolt
  A solver for the coupled and decoupled electron and phonon Boltzmann transport equations.
  ☆52Updated last month
• romerogroup / MechElastic
  A Python library to calculate elastic properties of materials.
  ☆60Updated 2 months ago
• bjmorgan / VASP-Utilities
  A collection of command line utilities for manipulating VASP input / outpu
  ☆25Updated 3 years ago
• atztogo / cogue
  Crsytal simulation tools
  ☆10Updated this week
• lingtikong / phana
  ☆27Updated last year
• yambo-code / yambopy
  Python scripts to manage and postprocess quantum espresso and yambo calculation.
  ☆16Updated last week
• pylada / pylada-light
  A physics computational framework for python and ipython
  ☆38Updated 3 months ago
• Baijianlu / mDCThermalC
  A software to calculate thermal conductivity quickly and accurately
  ☆35Updated 5 years ago
• jarvist / Julia-Phonons
  Julia codes to play with Phonons
  ☆24Updated 6 years ago
• tkotani / ecalj
  The quasiparticle self-consistent GW method in the PMT method (LAPW+LMTO+Lo).
  ☆33Updated last month
• DallasTrinkle / Onsager
  Onsager coefficients for interstitial and vacancy-mediated diffusion
  ☆13Updated 8 months ago
• Atomistica / atomistica
  Atomistica is a library of interatomic potentials that is compatible with ASE and LAMMPS
  ☆88Updated last week
• uw-cmg / MAST
  MAterials Simulation Toolkit for use with pymatgen
  ☆17Updated last year
• brandongc / lfdft
  Density Functional Theory with Finite Difference and Lagrange Function Basis Sets
  ☆14Updated 9 years ago
• fermisurfaces / IFermi
  Fermi surface generation, analysis and visualisation.
  ☆96Updated last week
• jochym / Elastic
  A module for ASE for elastic constants calculation.
  ☆46Updated 8 months ago
• janberges / elphmod
  Python modules for electron–phonon models
  ☆36Updated last week
• anharmonic / d3q
  D3Q + thermal2
  ☆26Updated 3 weeks ago
• potfit / potfit
  potfit force-matching code
  ☆41Updated last year
• prisms-center / CASMcode
  First-principles statistical mechanical software for the study of multi-component crystalline solids
  ☆118Updated last year
• Z2PackDev / TBmodels
  A tool for creating and manipulating tight-binding models.
  ☆40Updated 7 months ago
• WMD-group / Phonons
  A collection of structures, force constants and phonon data obtained from first-principles calculations
  ☆40Updated 5 years ago
• ttadano / ALM
  ☆21Updated last year
• aoterodelaroza / gibbs2
  Thermodynamics of solids in the quasiharmonic approximation.
  ☆38Updated last week
• symmy596 / SurfinPy
  Thermodynamic Phase Diagram Generator
  ☆55Updated 3 years ago
• nanoengineering / EPW-nano
  Modified EPW code for first principles calculation of electron transport and thermoelectric property of materials, including electron-pho…
  ☆27Updated 5 years ago
• pnieves2019 / MAELAS
  Software to calculate magnetostriction coefficients and magnetoelastic constants
  ☆17Updated 2 years ago
• PhasesResearchLab / ESPEI
  Fitting thermodynamic models with pycalphad - https://doi.org/10.1557/mrc.2019.59
  ☆75Updated last month
• KeivanS / Anharmonic-lattice-dynamics
  Set of codes to extract force constants from force-displacements data, calculate phonon dispersion (FOCEX) and thermal transport properti…
  ☆16Updated 2 months ago
• elcorto / pwtools
  pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LA…
  ☆70Updated 4 months ago