Alternatives and similar repositories for elate

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

• oekosheri / GB_code
  A grain boundary generation code
  ☆76Updated 2 years ago
• romerogroup / MechElastic
  A Python library to calculate elastic properties of materials.
  ☆59Updated 3 months ago
• usnistgov / atomman
  Atomistic Manipulation Toolkit
  ☆92Updated 2 months ago
• jochym / Elastic
  A module for ASE for elastic constants calculation.
  ☆47Updated 9 months ago
• wojdyr / gosam
  generator of simple atomistic models
  ☆28Updated 7 years ago
• vasp-dev / py4vasp
  Python interface for VASP
  ☆87Updated last week
• elcorto / pwtools
  pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LA…
  ☆71Updated 5 months ago
• ksyang2013 / aimsgb
  Ab-initio Interface Materials Simulation Project for Grain Boundaries (AIMSGB)
  ☆66Updated last year
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆81Updated 5 months ago
• phonopy / phono3py
  A simulation package of phonon-phonon interaction related properties
  ☆148Updated this week
• abinit / abipy
  Open-source library for analyzing the results produced by ABINIT
  ☆129Updated this week
• materialsproject / workshop
  The Materials Project Workshop Curriculum
  ☆116Updated 2 years ago
• 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…
  ☆73Updated last year
• spparks / spparks
  SPPARKS Kinetic and Metropolis Monte Carlo simulator
  ☆75Updated 2 weeks ago
• hitliaomq / ElasticPOST
  POST code for second order elastic constant
  ☆44Updated 5 years ago
• WMD-group / MacroDensity
  Python package to analyse electron density & electrostatic potential grids
  ☆88Updated last year
• abelcarreras / DynaPhoPy
  Phonon anharmonicity analysis from molecular dynamics
  ☆133Updated 3 weeks ago
• zhongliliu / elastool
  A toolkit for automatic calculation and analysis of elastic constants
  ☆53Updated last year
• orex / supercell
  The program allows you to create regular structure supercell from cif file with partial occupancy and/or substitutions.
  ☆103Updated last year
• pipidog / DFTtoolbox
  A toolbox for quickly build inputs and analyze results of DFT codes
  ☆44Updated 2 years ago
• mturiansky / nonrad
  Implementation for computing nonradiative recombination rates in semiconductors
  ☆50Updated 2 weeks ago
• henniggroup / GASP-python
  Genetic algorithm for structure and phase prediction interfaced to GULP, LAMMPS and VASP.
  ☆57Updated 2 years ago
• keeeto / VASP-Elastic
  Extracts full elastic tensor from VASP OUTCAR and calculates some useful quantities
  ☆26Updated 10 years ago
• henniggroup / MPInterfaces
  Python package that enables high throughput analysis of interfaces(two dimensional materials, hetero-structures, nanoparticles with and w…
  ☆76Updated last year
• aiida-vasp / aiida-vasp
  A plugin to AiiDA for running simulations with VASP
  ☆56Updated this week
• prisms-center / CASMcode
  First-principles statistical mechanical software for the study of multi-component crystalline solids
  ☆120Updated last year
• ajjackson / ascii-phonons
  Blender extensions for illustrations of phonons
  ☆66Updated 6 years ago
• sissaschool / sportran
  A code to estimate transport coefficients from the cepstral analysis of a (multi)variate current stationary time series -- [FKA "thermoce…
  ☆43Updated last month
• fermisurfaces / IFermi
  Fermi surface generation, analysis and visualisation.
  ☆97Updated 3 weeks ago
• materialsvirtuallab / snap
  Repository for spectral neighbor analysis potential (SNAP) model development.
  ☆37Updated 5 years ago