Alternatives and similar repositories for hybrid-perovskites

Users that are interested in hybrid-perovskites are comparing it to the libraries listed below

• WMD-group / MacroDensity
  Python package to analyse electron density & electrostatic potential grids
  ☆87Updated last year
• skelton-group / Phonopy-Spectroscopy
  A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.
  ☆167Updated this week
• materialsproject / mpmorph
  MPmorph is a collection of tools to run and analyze ab-initio molecular dynamics (AIMD) calculations run with VASP, and is currently unde…
  ☆72Updated last year
• SMTG-Bham / ShakeNBreak
  Defect structure-searching employing chemically-guided bond distortions
  ☆98Updated 3 weeks ago
• materialsvirtuallab / pymatgen-analysis-diffusion
  This add-on to pymatgen provides tools for analyzing diffusion in materials.
  ☆123Updated this week
• hackingmaterials / amset
  Electronic transport properties from first-principles calculations
  ☆153Updated last week
• ulissigroup / GASpy
  ☆70Updated 4 years ago
• abelcarreras / phonolammps
  LAMMPS interface for phonon calculations using phonopy
  ☆87Updated 11 months ago
• henniggroup / MPInterfaces
  Python package that enables high throughput analysis of interfaces(two dimensional materials, hetero-structures, nanoparticles with and w…
  ☆75Updated last year
• oekosheri / GB_code
  A grain boundary generation code
  ☆69Updated last year
• EfremBraun / calc-ir-spectra-from-lammps
  This code shows how to calculate an IR spectrum from a LAMMPS MD simulation.
  ☆52Updated 7 years ago
• hackingmaterials / robocrystallographer
  Automatic generation of crystal structure descriptions.
  ☆123Updated 2 weeks ago
• abelcarreras / DynaPhoPy
  Phonon anharmonicity analysis from molecular dynamics
  ☆130Updated 9 months ago
• vasp-dev / py4vasp
  Python interface for VASP
  ☆85Updated this week
• orex / supercell
  The program allows you to create regular structure supercell from cif file with partial occupancy and/or substitutions.
  ☆102Updated last year
• materialsproject / workshop
  The Materials Project Workshop Curriculum
  ☆116Updated 2 years ago
• henniggroup / VASPsol
  Solvation model for the plane wave DFT code VASP.
  ☆157Updated last year
• SMTG-Bham / sumo
  Heavyweight plotting tools for ab initio calculations
  ☆226Updated 3 months ago
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆80Updated 2 months ago
• SMTG-Bham / doped
  doped is a Python software for the generation, pre-/post-processing and analysis of defect supercell calculations, implementing the defec…
  ☆198Updated 3 weeks ago
• materialsvirtuallab / snap
  Repository for spectral neighbor analysis potential (SNAP) model development.
  ☆36Updated 5 years ago
• jkitchin / vasp
  New ASE compliant Python interface to VASP
  ☆132Updated 3 years ago
• CederGroupHub / smol
  Statistical Mechanics on Lattices
  ☆82Updated this week
• MaterSim / PyXtal_FF
  Machine Learning Interatomic Potential Predictions
  ☆91Updated last year
• romerogroup / pyprocar
  A Python library for electronic structure pre/post-processing
  ☆183Updated last week
• VASPsol / VASPsol
  ☆57Updated 3 months ago
• ICAMS / calphy
  A Python library and command line interface for automated free energy calculations
  ☆81Updated last week
• WMD-group / ASE-Tutorials
  Examples of using the Atomic Simulation Environment
  ☆36Updated 9 years ago
• QijingZheng / pyband
  band plot using python matplotlib
  ☆166Updated 9 months ago
• henniggroup / GASP-python
  Genetic algorithm for structure and phase prediction interfaced to GULP, LAMMPS and VASP.
  ☆57Updated last year