Alternatives and similar repositories for SPARC-X-API

Users that are interested in SPARC-X-API are comparing it to the libraries listed below

• ICAMS / python-ace
  ☆101Updated last year
• tdep-developers / tdep
  The Temperature Dependent Effective Potentials (TDEP) code
  ☆96Updated last month
• ICAMS / grace-tensorpotential
  GRACE models and gracemaker (as implemented in TensorPotential package)
  ☆78Updated 3 weeks ago
• AegisIK / DistMLIP
  DistMLIP: A Distributed Inference Library for Fast, Large Scale Atomistic Simulation
  ☆91Updated 3 months ago
• CederGroupHub / smol
  Statistical Mechanics on Lattices
  ☆91Updated last week
• materialyzeai / matcalc
  A python library for calculating materials properties from the PES
  ☆129Updated last week
• WMD-group / PDynA
  Python package to analyse the structural dynamics of perovskites
  ☆48Updated 4 months ago
• sissaschool / sportran
  A code to estimate transport coefficients from the cepstral analysis of a (multi)variate current stationary time series -- [FKA "thermoce…
  ☆43Updated 4 months ago
• killiansheriff / WarrenCowleyParameters
  OVITO Python modifier to compute the Warren-Cowley parameters.
  ☆37Updated 9 months ago
• Xiaoxun-Gong / HPRO
  HPRO: Hamiltonian Projection and Reconstruction to atomic Orbitals
  ☆28Updated last year
• materialyzeai / matpes
  A foundational potential energy dataset for materials
  ☆49Updated last month
• ulissigroup / vasp-interactive
  ☆72Updated 2 years ago
• SSCHAcode / python-sscha
  The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
  ☆68Updated 2 months ago
• SMTG-Bham / ShakeNBreak
  Defect structure-searching employing chemically-guided bond distortions
  ☆111Updated this week
• simonverret / materials_data_api_scripts
  scripts to load all data from ICSD, Materials Project, and OQMD
  ☆68Updated 3 years ago
• dskoda / quests
  Quick Uncertainty and Entropy via STructural Similarity
  ☆54Updated 3 weeks ago
• JinukMoon / CatBench
  CatBench - Benchmark Framework of Machine Learning Interatomic Potentials in Adsorption Energy Predictions
  ☆45Updated last month
• dogusariturk / PhaseForge
  PhaseForge is a framework for high-throughput alloy phase diagram prediction using machine learning interatomic potentials (MLIPs) integr…
  ☆55Updated 2 months ago
• SMTG-Bham / easyunfold
  Band structure unfolding made easy!
  ☆58Updated 3 weeks ago
• dgehringer / sqsgenerator
  A tool for finding optimized SQS structures tool written in C++
  ☆60Updated 3 weeks ago
• llnl / csld
  Compressive sensing lattice dynamics
  ☆32Updated 10 months ago
• BingqingCheng / cace
  ☆113Updated this week
• enze-chen / grip
  Grand canonical optimization of grain boundary phases.
  ☆30Updated 8 months ago
• ICAMS / calphy
  A Python library and command line interface for automated free energy calculations
  ☆86Updated 3 weeks ago
• autoatml / autoplex
  Code for automated fitting of machine learned interatomic potentials.
  ☆134Updated this week
• abelcarreras / phonolammps
  LAMMPS interface for phonon calculations using phonopy
  ☆90Updated 2 months ago
• utf / pymlff
  A lightweight python package for reading and writing VASP ML_AB files
  ☆44Updated 10 months ago
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆83Updated 7 months ago
• superstar54 / weas-widget
  A widget to visualize and edit atomic structures in Jupyter Notebook
  ☆45Updated last week
• ajmedford / catmap
  Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
  ☆14Updated 10 years ago