Alternatives and similar repositories for Yell:

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

• ajjackson / ascii-phonons
  Blender extensions for illustrations of phonons
  ☆62Updated 5 years ago
• pace-neutrons / Euphonic
  Euphonic is a Python package for efficient simulation of phonon bandstructures, density of states and inelastic neutron scattering intens…
  ☆31Updated last week
• mturiansky / nonrad
  Implementation for computing nonradiative recombination rates in semiconductors
  ☆42Updated 4 months ago
• pipidog / DFTtoolbox
  A toolbox for quickly build inputs and analyze results of DFT codes
  ☆41Updated last year
• aiida-vasp / aiida-vasp
  A plugin to AiiDA for running simulations with VASP
  ☆50Updated this week
• sozykinsa / GUI4dft
  GUI4dft - first free SIESTA oriented GUI
  ☆24Updated last week
• WMD-group / Crystal_structures
  A collection of crystal structures from first-principles simulations
  ☆28Updated 4 years ago
• wojdyr / gosam
  generator of simple atomistic models
  ☆25Updated 6 years ago
• SMTG-Bham / easyunfold
  Band structure unfolding made easy!
  ☆45Updated last week
• bjmorgan / vasppy
  A Python suite for manipulating VASP input and output
  ☆45Updated 8 months ago
• SMTG-Bham / galore
  Gaussian and Lorentzian smearing of simulated spectra
  ☆38Updated 4 months ago
• SSCHAcode / python-sscha
  The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
  ☆59Updated 3 months ago
• kylebystrom / pawpyseed
  Parallel C/Python package for numerical analysis of PAW DFT wavefunctions
  ☆32Updated 3 years ago
• usnistgov / atomman
  Atomistic Manipulation Toolkit
  ☆83Updated 9 months ago
• aiidateam / aiida-quantumespresso
  The official AiiDA plugin for Quantum ESPRESSO
  ☆58Updated 2 weeks ago
• JMSkelton / ModeMap
  A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.
  ☆41Updated 9 months ago
• abinit / pseudo_dojo
  Python framework for generating and validating pseudo potentials
  ☆42Updated last year
• SSCHAcode / CellConstructor
  A python utilities to handle with atomic structures and interfacing with common formats (xyz and quantum-espresso).
  ☆19Updated 3 months ago
• DanPorter / Dans_Diffraction
  Reads crystallographic cif files and simulates diffraction
  ☆58Updated last week
• jrschmidt2 / periodic-NBO
  ☆36Updated 5 years ago
• aiidateam / aiida-cp2k
  The CP2K plugin for the AiiDA workflow and provenance engine.
  ☆23Updated 2 weeks ago
• QijingZheng / VaspPoscarMayavi
  Use 3D visualization software Mayavi to visualize VASP POSCAR file.
  ☆29Updated last year
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆78Updated last year
• jochym / Elastic
  A module for ASE for elastic constants calculation.
  ☆40Updated 3 weeks ago
• dalcorso / pslibrary
  A library of ultrasoft and PAW pseudopotentials
  ☆75Updated 2 years ago
• skelton-group / Phono3py-Power-Tools
  Tools for Phono(3)py power users.
  ☆32Updated last year
• gcmt-group / sod
  Site-Occupation Disorder
  ☆39Updated last year
• WMD-group / MacroDensity
  Python package to analyse electron density & electrostatic potential grids
  ☆85Updated last year
• jochym / qe-doc
  Docs and examples for Quantum-Espresso
  ☆15Updated 7 years ago
• JohnKendrick / PDielec
  PDielec is a Python package for post-processing solid state QM and MM calculations of Infrared Spectra
  ☆13Updated 3 months ago