Alternatives and similar repositories for burai:

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

• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆79Updated last year
• yuzie007 / upho
  Band unfolding for phonons
  ☆54Updated 6 months ago
• pipidog / DFTtoolbox
  A toolbox for quickly build inputs and analyze results of DFT codes
  ☆42Updated last year
• mturiansky / nonrad
  Implementation for computing nonradiative recombination rates in semiconductors
  ☆48Updated 6 months ago
• dalcorso / thermo_pw
  Thermo_pw is a driver of quantum-ESPRESSO routines for the automatic computation of ab-initio material properties.
  ☆53Updated this week
• pipidog / ONCVPSP
  Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
  ☆81Updated 5 years ago
• ajjackson / ascii-phonons
  Blender extensions for illustrations of phonons
  ☆65Updated 6 years ago
• tdep-developers / tdep
  The Temperature Dependent Effective Potentials (TDEP) code
  ☆79Updated last week
• SMTG-Bham / easyunfold
  Band structure unfolding made easy!
  ☆53Updated 2 weeks ago
• houzf / poscar2xsf
  Convert a POSCAR-format-like file to a XSF file (visualized by XCrySDen)
  ☆18Updated 3 years ago
• giovannipizzi / seekpath
  A module to obtain and visualize k-vector coefficients and obtain band paths in the Brillouin zone of crystal structures
  ☆133Updated last month
• hungpham2017 / pyWannier90
  A Wannier90 python interface for VASP and PySCF
  ☆38Updated last year
• SMTG-Bham / surfaxe
  Dealing with slabs for first principles calculations of surfaces
  ☆63Updated last year
• SSCHAcode / python-sscha
  The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
  ☆61Updated 5 months ago
• hungpham2017 / mcu
  Modeling and Crystallographic Utilities
  ☆50Updated last year
• elcorto / pwtools
  pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LA…
  ☆68Updated 9 months ago
• rehnd / VASP-plot-modes
  Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP
  ☆32Updated last year
• Quantum-Dynamics-Hub / libra-code
  ☆52Updated this week
• jabl / vasputil
  Command-line utilities and Python libraries designed to make life with VASP easier
  ☆54Updated 5 years ago
• pranabdas / espresso
  Notes and tutorials on Density Functional Theory calculation using Quantum ESPRESSO.
  ☆130Updated 2 weeks ago
• mailhexu / TB2J
  a python package for computing magnetic interaction parameters
  ☆79Updated last week
• gcmt-group / sod
  Site-Occupation Disorder
  ☆42Updated last month
• afonari / emc
  Effective Mass Calculator for Semiconductors
  ☆106Updated 4 years ago
• JMSkelton / ModeMap
  A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.
  ☆41Updated last year
• dalcorso / pslibrary
  A library of ultrasoft and PAW pseudopotentials
  ☆79Updated 2 years ago
• WMD-group / MacroDensity
  Python package to analyse electron density & electrostatic potential grids
  ☆87Updated last year
• irreducible-representations / irrep
  ☆65Updated 3 weeks ago
• abelcarreras / DynaPhoPy
  Phonon anharmonicity analysis from molecular dynamics
  ☆124Updated 6 months ago
• WatsonGroupTCD / Occupation-matrix-control-in-VASP
  Occupation matrix control modification VASP
  ☆46Updated 5 years ago
• vasp-dev / py4vasp
  Python interface for VASP
  ☆82Updated this week