Alternatives and similar repositories for LobsterPy

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

• SMTG-Bham / surfaxe
  Dealing with slabs for first principles calculations of surfaces
  ☆63Updated last year
• materialsproject / pymatgen-analysis-defects
  Defect analysis modules for pymatgen
  ☆49Updated 2 weeks ago
• SMTG-Bham / ShakeNBreak
  Defect structure-searching employing chemically-guided bond distortions
  ☆93Updated 2 weeks ago
• SMTG-Bham / easyunfold
  Band structure unfolding made easy!
  ☆53Updated 2 weeks ago
• ulissigroup / vasp-interactive
  ☆67Updated 2 years ago
• ICAMS / calphy
  A Python library and command line interface for automated free energy calculations
  ☆79Updated last month
• tdep-developers / tdep
  The Temperature Dependent Effective Potentials (TDEP) code
  ☆83Updated this week
• advancesoftcorp / lammps
  Compiled binaries and sources of LAMMPS, redistributed by AdvanceSoft Corp.
  ☆52Updated last week
• WMD-group / PDynA
  Python package to analyse the structural dynamics of perovskites
  ☆43Updated 6 months ago
• utf / pymlff
  A lightweight python package for reading and writing VASP ML_AB files
  ☆35Updated 3 months ago
• CederGroupHub / smol
  Statistical Mechanics on Lattices
  ☆82Updated last week
• QijingZheng / VaspVib2XSF
  Visualize vibrational modes from VASP calculations
  ☆41Updated 5 months ago
• mbkumar / pycdt
  ☆53Updated 2 years ago
• materialsvirtuallab / matcalc
  A python library for calculating materials properties from the PES
  ☆93Updated last week
• zishengz / gocia
  Global Optimizer for Clusters, Interfaces, and Adsorbates
  ☆28Updated 3 months ago
• penghao-xiao / Electrochemical-barrier
  ☆27Updated 2 years ago
• autoatml / autoplex
  Code for automated fitting of machine learned interatomic potentials.
  ☆78Updated this week
• zadorlab / pynta
  Pynta - an automated workflow for reaction path exploration on metallic surfaces
  ☆39Updated this week
• ldwillia / SL3ME
  A Python3 implementation of the Spectroscopic Limited Maximum Efficiency (SLME) analysis of solar absorbers
  ☆29Updated 3 years ago
• kumagai-group / pydefect
  Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.
  ☆59Updated 3 weeks ago
• abelcarreras / phonolammps
  LAMMPS interface for phonon calculations using phonopy
  ☆87Updated 9 months ago
• SMTG-Bham / ThermoParser
  A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…
  ☆52Updated last month
• hsulab / GDPy
  Generating Deep Potential with Python
  ☆67Updated last week
• computron / pymatgen_tutorials
  Tutorials for using the pymatgen library
  ☆50Updated 3 weeks ago
• bjmorgan / vasppy
  A Python suite for manipulating VASP input and output
  ☆46Updated last year
• VASPsol / VASPsol
  ☆49Updated 2 months ago
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆80Updated last month
• yuanyue-liu-group / CP-VASP
  ☆44Updated 8 months ago
• sissaschool / sportran
  A code to estimate transport coefficients from the cepstral analysis of a (multi)variate current stationary time series -- [FKA "thermoce…
  ☆42Updated 5 months ago
• LePingKYXK / Velocity-ACF
  Calculate Spectrum Based on Fast Fourier Transform (FFT) of the Velocity Autocorrelation Function (VACF).
  ☆26Updated 2 years ago