Alternatives and similar repositories for phana:

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

• wojdyr / gosam
  generator of simple atomistic models
  ☆27Updated 6 years ago
• jochym / Elastic
  A module for ASE for elastic constants calculation.
  ☆41Updated 3 months ago
• kylebystrom / pawpyseed
  Parallel C/Python package for numerical analysis of PAW DFT wavefunctions
  ☆33Updated 3 years ago
• costrouc / dftfit
  Interatomic potential creating using DFT training data.
  ☆28Updated 5 years ago
• yuzie007 / upho
  Band unfolding for phonons
  ☆54Updated 6 months ago
• abelcarreras / phonolammps
  LAMMPS interface for phonon calculations using phonopy
  ☆86Updated 8 months ago
• c-niu / sqs2poscar
  A c++ code to convert bestsqs.out from mcsqs (ATAT) to POSCAR for VASP.
  ☆31Updated 9 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
• mturiansky / nonrad
  Implementation for computing nonradiative recombination rates in semiconductors
  ☆48Updated 6 months ago
• delton137 / PhononSED
  Calculates Projected Phonon Spectral Energy Density (SED) from molecular dynamics atomic velocity data and phonon eigenvectors
  ☆17Updated 4 years ago
• siesta-project / tutorials
  Tutorial material for hands-on sessions (work in progress)
  ☆24Updated 3 years ago
• keeeto / VASP-Elastic
  Extracts full elastic tensor from VASP OUTCAR and calculates some useful quantities
  ☆26Updated 9 years ago
• ZhongweiZhangsite / WPPT
  Wavelike and Particlelike Phonon Transport (WPPT) Solver
  ☆27Updated 4 months ago
• JMSkelton / ModeMap
  A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.
  ☆41Updated last year
• bjmorgan / vasppy
  A Python suite for manipulating VASP input and output
  ☆46Updated 10 months ago
• QijingZheng / VaspPoscarMayavi
  Use 3D visualization software Mayavi to visualize VASP POSCAR file.
  ☆30Updated last year
• MTD-group / Fermi-Surface
  VASP subtool to draw Fermi-Surface; creates input file for Xcrysden
  ☆37Updated 2 years ago
• gcmt-group / sod
  Site-Occupation Disorder
  ☆42Updated last month
• SMTG-Bham / easyunfold
  Band structure unfolding made easy!
  ☆53Updated 2 weeks ago
• skelton-group / Phono3py-Power-Tools
  Tools for Phono(3)py power users.
  ☆33Updated last year
• SMTG-Bham / ThermoParser
  A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…
  ☆52Updated last week
• pylada / pylada-defects
  A computational framework to automate point defect calculations
  ☆36Updated 6 years ago
• ajjackson / ase-tutorial-symmetry
  Tutorial notebook for symmetry features in ASE
  ☆24Updated 5 years ago
• conodipaola / kg4vasp
  Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP
  ☆23Updated 4 years ago
• rohskopf / modecode
  Massively parallel vibrational mode calculator.
  ☆23Updated 8 months ago
• dgehringer / sqsgenerator
  A command line tool written in Python/C++ for finding optimized SQS structures
  ☆46Updated last week
• tomkeus / vasp_unfold
  ☆29Updated 10 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 4 months ago
• sozykinsa / GUI4dft
  GUI4dft - first free SIESTA oriented GUI
  ☆24Updated this week
• potfit / potfit
  potfit force-matching code
  ☆36Updated last year