Alternatives and similar repositories for perturbopy

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

• jarvist / Julia-Phonons
  Julia codes to play with Phonons
  ☆24Updated 7 years ago
• ttadano / ALM
  ☆21Updated last year
• munrojm / DiSPy
  Utility for applying the distortion symmetry method.
  ☆28Updated last year
• TnakaTnakaTnaka / PHNEGF
  Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory
  ☆23Updated 5 years ago
• LLNL / csld
  Compressive sensing lattice dynamics
  ☆31Updated 9 months ago
• bjmorgan / py-sc-fermi
  py-sc-fermi is a materials modelling code for calculating self-consistent Fermi energies and defect concentrations under thermodynamic eq…
  ☆29Updated 5 months ago
• kylebystrom / pawpyseed
  Parallel C/Python package for numerical analysis of PAW DFT wavefunctions
  ☆33Updated 4 years ago
• msg-byu / autoGR
  Generating k-point grids with the best folding ratio or fewest irreducible k-points for a given density
  ☆40Updated last year
• WMD-group / Phonons
  A collection of structures, force constants and phonon data obtained from first-principles calculations
  ☆40Updated 5 years ago
• superstar54 / weas-widget
  A widget to visualize and edit atomic structures in Jupyter Notebook
  ☆40Updated 9 months ago
• aiidateam / aiida-wannier90-workflows
  A collection of advanced automated workflows to compute Wannier functions using AiiDA and the Wannier90 code
  ☆20Updated 2 weeks ago
• pace-neutrons / Euphonic
  Euphonic is a Python package for efficient simulation of phonon bandstructures, density of states and inelastic neutron scattering intens…
  ☆38Updated last week
• anharmonic / d3q
  D3Q + thermal2
  ☆26Updated last month
• SMTG-Bham / easyunfold
  Band structure unfolding made easy!
  ☆58Updated last month
• DMFTwDFT-project / DMFTwDFT
  DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages
  ☆60Updated 3 years ago
• marcobn / PAOFLOW
  Utility to construct and operate on Hamiltonians from the Projections of DFT wfc on Atomic Orbital bases (PAO)
  ☆47Updated 2 weeks ago
• tyst3273 / pynamic-structure-factor
  python code to calculate inelastic-neutron-scattering dynamic structure factor, S(Q,w), from molecular dynamics trajectories using parall…
  ☆19Updated 3 months ago
• WMD-group / CarrierCapture.jl
  Julia package to compute trap-assisted electron and hole capture in semiconductors
  ☆57Updated 4 months ago
• vossjo / libbeef
  Library for Bayesian error estimation functionals for use in density functional theory codes
  ☆27Updated 2 years ago
• ltalirz / atomistic-software
  Tracking citations of atomistic simulation engines
  ☆26Updated last week
• tdep-developers / tdep
  The Temperature Dependent Effective Potentials (TDEP) code
  ☆94Updated last week
• spglib / spgrep
  On-the-fly generator of space-group irreducible representations
  ☆56Updated this week
• WMD-group / PyTASER
  Python package to simulate differential absorption spectra of crystals from first principles
  ☆32Updated 4 months ago
• aiidateam / qe-tools
  Python tools for Quantum ESPRESSO
  ☆36Updated last month
• tdep-developers / tdep-tutorials
  TDEP Tutorials
  ☆34Updated 6 months ago
• fermisurfaces / IFermi
  Fermi surface generation, analysis and visualisation.
  ☆98Updated last month
• libAtoms / workflow
  python workflow toolkit
  ☆45Updated this week
• SSCHAcode / python-sscha
  The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
  ☆67Updated last month
• skelton-group / Phono3py-Power-Tools
  Tools for Phono(3)py power users.
  ☆34Updated 2 years ago
• spglib / spinspg
  Python package for detecting spin space group on top of spglib
  ☆19Updated last month