Alternatives and similar repositories for pslibrary

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

• pipidog / ONCVPSP
  Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
  ☆82Updated 5 years ago
• SSCHAcode / python-sscha
  The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
  ☆65Updated this week
• henriquemiranda / phononwebsite
  Visualise lattice vibrations
  ☆98Updated 2 months ago
• orex / supercell
  The program allows you to create regular structure supercell from cif file with partial occupancy and/or substitutions.
  ☆102Updated last year
• band-unfolding / bandup
  BandUP: Band Unfolding code for Plane-wave based calculations
  ☆100Updated 4 years ago
• giovannipizzi / seekpath
  A module to obtain and visualize k-vector coefficients and obtain band paths in the Brillouin zone of crystal structures
  ☆138Updated 4 months ago
• UppASD / UppASD
  The UppASD package is a simulation tool for atomistic spin dynamics and Monte Carlo simulations of Heisenberg spin systems.
  ☆91Updated 3 months ago
• irreducible-representations / irrep
  ☆67Updated 2 weeks ago
• mailhexu / TB2J
  a python package for computing magnetic interaction parameters
  ☆80Updated last week
• abelcarreras / phonolammps
  LAMMPS interface for phonon calculations using phonopy
  ☆87Updated 11 months ago
• dalcorso / thermo_pw
  Thermo_pw is a driver of quantum-ESPRESSO routines for the automatic computation of ab-initio material properties.
  ☆54Updated last week
• ajjackson / ascii-phonons
  Blender extensions for illustrations of phonons
  ☆66Updated 6 years ago
• shankar1729 / jdftx
  JDFTx: software for joint density functional theory
  ☆92Updated 2 months ago
• vasp-dev / py4vasp
  Python interface for VASP
  ☆85Updated last week
• phoebe-team / phoebe
  A high-performance framework for solving phonon and electron Boltzmann equations
  ☆106Updated last week
• pipidog / DFTtoolbox
  A toolbox for quickly build inputs and analyze results of DFT codes
  ☆43Updated last year
• QijingZheng / VaspPoscarMayavi
  Use 3D visualization software Mayavi to visualize VASP POSCAR file.
  ☆33Updated 2 years ago
• QijingZheng / Hefei-NAMD
  ab-initio nonadiabatic molecular dynamics program
  ☆108Updated last year
• WatsonGroupTCD / Occupation-matrix-control-in-VASP
  Occupation matrix control modification VASP
  ☆49Updated 5 years ago
• aiida-vasp / aiida-vasp
  A plugin to AiiDA for running simulations with VASP
  ☆55Updated this week
• ttadano / alamode
  Ab initio simulator for thermal transport and lattice anharmonicity
  ☆173Updated this week
• hungpham2017 / mcu
  Modeling and Crystallographic Utilities
  ☆50Updated 2 years ago
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆80Updated 2 months ago
• pranabdas / espresso
  Notes and tutorials on Density Functional Theory calculation using Quantum ESPRESSO.
  ☆139Updated 2 weeks ago
• romerogroup / pyprocar
  A Python library for electronic structure pre/post-processing
  ☆183Updated 2 weeks ago
• yuzie007 / upho
  Band unfolding for phonons
  ☆55Updated 9 months ago
• BerkeleyGW / BGWpy
  BerkeleyGW python
  ☆30Updated 3 years ago
• JMSkelton / VASP-Examples
  A collection of examples for running different types of VASP calculations.
  ☆31Updated 8 years ago
• afonari / emc
  Effective Mass Calculator for Semiconductors
  ☆108Updated 4 years ago
• abelcarreras / DynaPhoPy
  Phonon anharmonicity analysis from molecular dynamics
  ☆130Updated 8 months ago