Alternatives and similar repositories for Yell

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

• tproffen / DiffuseCode
  Suite of programs to simulate disordered and nanomaterials
  ☆60Updated last week
• usnistgov / atomman
  Atomistic Manipulation Toolkit
  ☆92Updated 2 months ago
• hackingmaterials / robocrystallographer
  Automatic generation of crystal structure descriptions.
  ☆125Updated this week
• ksyang2013 / aimsgb
  Ab-initio Interface Materials Simulation Project for Grain Boundaries (AIMSGB)
  ☆66Updated last year
• abinit / abipy
  Open-source library for analyzing the results produced by ABINIT
  ☆129Updated this week
• phonopy / phono3py
  A simulation package of phonon-phonon interaction related properties
  ☆148Updated last week
• jochym / Elastic
  A module for ASE for elastic constants calculation.
  ☆47Updated 9 months ago
• DanPorter / Dans_Diffraction
  Reads crystallographic cif files and simulates diffraction
  ☆72Updated last month
• msg-byu / enumlib
  Derivative structure enumeration library
  ☆79Updated 11 months ago
• 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
• bjheinen / LiquidDiffract
  LiquidDiffract is a GUI program to process experimental X-ray diffraction data of liquids/amorphous solids.
  ☆20Updated 4 months ago
• Materials-Consortia / OPTIMADE
  Specification of a common REST API for access to materials databases
  ☆98Updated last month
• ajjackson / ascii-phonons
  Blender extensions for illustrations of phonons
  ☆66Updated 6 years ago
• lucydot / effmass
  Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.
  ☆81Updated 5 months ago
• oekosheri / GB_code
  A grain boundary generation code
  ☆77Updated 2 years ago
• SMTG-Bham / easyunfold
  Band structure unfolding made easy!
  ☆57Updated last week
• materialsvirtuallab / nano106
  Course materials for NANO 106 - Crystallography of Materials
  ☆36Updated 3 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
• diffpy / diffpy.structure
  Crystal structure container and parsers for structure formats.
  ☆35Updated 3 months ago
• henriquemiranda / phononwebsite
  Visualise lattice vibrations
  ☆103Updated 4 months ago
• SSCHAcode / python-sscha
  The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).
  ☆67Updated 2 weeks ago
• aiidateam / aiida-cp2k
  The CP2K plugin for the AiiDA workflow and provenance engine.
  ☆25Updated 3 weeks ago
• coudertlab / elate
  ELATE: Elastic tensor analysis
  ☆86Updated last month
• mturiansky / nonrad
  Implementation for computing nonradiative recombination rates in semiconductors
  ☆50Updated 2 weeks ago
• jacobjma / PyQSTEM
  A Python interface to the electron microscopy simulation program QSTEM
  ☆64Updated 5 years ago
• openkim / kim-api
  The Open Knowledgebase of Interatomic Models (OpenKIM) aims to be an online resource for standardized testing, long-term warehousing and …
  ☆32Updated last month
• WMD-group / MacroDensity
  Python package to analyse electron density & electrostatic potential grids
  ☆88Updated last year
• mhoffman / kmos
  kMC on steroids: A vigorous attempt to make lattice kinetic Monte Carlo modelling easier
  ☆57Updated 7 years ago
• potfit / potfit
  potfit force-matching code
  ☆42Updated last year
• HidekiMori-CIT / aenet-lammps
  This package provides the interface module between aenet [1] and LAMMPS [2], patch of aenet for the LAMMPS library, and Artificial Neural…
  ☆22Updated 2 years ago