Alternatives and similar repositories for quantumVITAS:

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

• hungpham2017 / mcu
  Modeling and Crystallographic Utilities
  ☆50Updated last year
• mailhexu / TB2J
  a python package for computing magnetic interaction parameters
  ☆74Updated 2 weeks ago
• mturiansky / nonrad
  Implementation for computing nonradiative recombination rates in semiconductors
  ☆42Updated 4 months ago
• BURAI-team / burai
  BURAI, a GUI system of Quantum ESPRESSO
  ☆63Updated 3 years ago
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆78Updated last year
• quantumNerd / Quantum-Espresso-Tutorial-2019-Slides
  ☆23Updated 5 years ago
• afonari / emc
  Effective Mass Calculator for Semiconductors
  ☆104Updated 4 years ago
• UppASD / UppASD
  The UppASD package is a simulation tool for atomistic spin dynamics and Monte Carlo simulations of Heisenberg spin systems.
  ☆87Updated this week
• pipidog / DFTtoolbox
  A toolbox for quickly build inputs and analyze results of DFT codes
  ☆41Updated last year
• SSCHAcode / python-sscha
  The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
  ☆59Updated 3 months ago
• zerothi / ts-tbt-sisl-tutorial
  Tutorials for the sisl-TBtrans-TranSiesta suite
  ☆40Updated 3 months ago
• phoebe-team / phoebe
  A high-performance framework for solving phonon and electron Boltzmann equations
  ☆95Updated last month
• quantumNerd / vasp_tutorial
  ☆30Updated 4 years 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
• nakib / elphbolt
  A solver for the coupled and decoupled electron and phonon Boltzmann transport equations.
  ☆45Updated this week
• SMTG-Bham / ThermoParser
  A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…
  ☆51Updated this week
• ajjackson / ascii-phonons
  Blender extensions for illustrations of phonons
  ☆62Updated 5 years ago
• oekosheri / GB_code
  A grain boundary generation code
  ☆62Updated last year
• CederGroupHub / smol
  Statistical Mechanics on Lattices
  ☆69Updated this week
• abelcarreras / DynaPhoPy
  Phonon anharmonicity analysis from molecular dynamics
  ☆119Updated 3 months ago
• ldwillia / SL3ME
  A Python3 implementation of the Spectroscopic Limited Maximum Efficiency (SLME) analysis of solar absorbers
  ☆28Updated 3 years ago
• c-niu / sqs2poscar
  A c++ code to convert bestsqs.out from mcsqs (ATAT) to POSCAR for VASP.
  ☆29Updated 8 years ago
• WMD-group / CarrierCapture.jl
  Julia package to compute trap-assisted electron and hole capture in semiconductors
  ☆56Updated 3 weeks ago
• WMD-group / Phonons
  A collection of structures, force constants and phonon data obtained from first-principles calculations
  ☆39Updated 4 years ago
• dceresoli / ce-tddft
  Real-time TDDFT for Quantum-Espresso
  ☆24Updated last year
• hackingmaterials / amset
  Electronic transport properties from first-principles calculations
  ☆137Updated this week
• qtm-iisc / Twister
  ☆47Updated last year
• santoshkumarradha / pysktb
  Scientific Python package for solving Slater Koster tight-binding topological hamiltonian
  ☆48Updated last year
• rehnd / VASP-plot-modes
  Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP
  ☆31Updated 10 months ago
• henriquemiranda / phononwebsite
  Visualise lattice vibrations
  ☆91Updated this week