Alternatives and similar repositories for autoGR:

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

• pace-neutrons / Euphonic
  Euphonic is a Python package for efficient simulation of phonon bandstructures, density of states and inelastic neutron scattering intens…
  ☆32Updated this week
• perturbo-code / perturbopy
  Suite of Python scripts for Perturbo testing and postprocessing
  ☆11Updated last month
• ltalirz / asetk
  Toolkit using the Atomistic Simulation Environment (ASE)
  ☆19Updated 4 years ago
• kylebystrom / pawpyseed
  Parallel C/Python package for numerical analysis of PAW DFT wavefunctions
  ☆33Updated 3 years ago
• rubel75 / fold2Bloch-VASP
  Unfolding the band structure of a supercell obtained with VASP
  ☆25Updated 2 years ago
• NickWoods1 / scf-xn-testsuite
  Set of Kohn-Sham DFT inputs (CASTEP format) for which the SCF iterations are difficult to converge
  ☆13Updated 5 years ago
• dgehringer / sqsgenerator
  A command line tool written in Python/C++ for finding optimized SQS structures
  ☆46Updated last week
• SMTG-Bham / easyunfold
  Band structure unfolding made easy!
  ☆53Updated last week
• cmdlab / pyGWBSE
  python workflow for GW-BSE calculation
  ☆28Updated last year
• pmla / evgraf
  Geometric analysis of crystal structures
  ☆15Updated 2 years ago
• ftherrien / p2ptrans
  An algorithm to match crystal structures atom-to-atom
  ☆52Updated 2 years ago
• JMSkelton / ModeMap
  A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.
  ☆41Updated last year
• utf / pymlff
  A lightweight python package for reading and writing VASP ML_AB files
  ☆36Updated 2 months ago
• SSCHAcode / CellConstructor
  A python utilities to handle with atomic structures and interfacing with common formats (xyz and quantum-espresso).
  ☆19Updated 5 months ago
• aiidateam / aiida-wannier90-workflows
  A collection of advanced automated workflows to compute Wannier functions using AiiDA and the Wannier90 code
  ☆18Updated 2 months ago
• jochym / Elastic
  A module for ASE for elastic constants calculation.
  ☆41Updated 3 months ago
• vossjo / libbeef
  Library for Bayesian error estimation functionals for use in density functional theory codes
  ☆24Updated 2 years ago
• BerkeleyGW / BGWpy
  BerkeleyGW python
  ☆31Updated 3 years ago
• sissaschool / sportran
  A code to estimate transport coefficients from the cepstral analysis of a (multi)variate current stationary time series -- [FKA "thermoce…
  ☆42Updated 4 months ago
• symfc / symfc
  Generate symmetrized force constants
  ☆21Updated last week
• llodeiro / DensityTool
  DensityTool post-processing program for VASP
  ☆30Updated last year
• aiida-phonopy / aiida-phonopy
  Phonon for AiiDA
  ☆19Updated 2 months ago
• flokno / tools.tdep
  ☆19Updated 4 months ago
• InWonYeu / interphon
  Interfacial Phonon code
  ☆26Updated 2 years ago
• QijingZheng / VaspPoscarMayavi
  Use 3D visualization software Mayavi to visualize VASP POSCAR file.
  ☆30Updated last year
• pmla / auguste
  Minimum-strain symmetrization of Bravais lattices
  ☆17Updated 4 years ago
• Chengcheng-Xiao / Periodic_NBO
  Natural Bond Orbital algorithm to handle systems characterized by periodic symmetry
  ☆20Updated 3 years ago
• tomkeus / vasp_unfold
  ☆29Updated 10 months ago
• Sassafrass6 / XtraCrysPy
  A crystallographic visualizer for Python, compatible with files from common softwares like Quantum ESPRESSO, VASP, CP2K, etc.
  ☆19Updated 6 months ago
• SSCHAcode / python-sscha
  The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
  ☆61Updated 5 months ago