glotzerlab / freudLinks
Powerful, efficient particle trajectory analysis in scientific Python.
☆308Updated this week
Alternatives and similar repositories for freud
Users that are interested in freud are comparing it to the libraries listed below
Sorting:
- Molecular dynamics and Monte Carlo soft matter simulation on GPUs.☆407Updated this week
- pyiron - an integrated development environment (IDE) for computational materials science.☆431Updated last month
- Materials science with Python at the atomic-scale☆225Updated 2 weeks ago
- DFTB+ general package for performing fast atomistic simulations☆401Updated this week
- Computational Crystallography Toolbox☆268Updated this week
- Read and write GSD files for use with HOOMD-blue.☆27Updated this week
- A python package for accessing various properties of elements, ions and isotopes in the periodic table of elements.☆271Updated last week
- libAtoms/QUIP molecular dynamics framework: https://libatoms.github.io☆376Updated last month
- Generally Applicable Atomic-Charge Dependent London Dispersion Correction☆202Updated 3 weeks ago
- Fortran and Python examples to accompany the book "Computer Simulation of Liquids" by Michael P. Allen and Dominic J. Tildesley (2nd edit…☆334Updated last month
- A hierarchical, component based molecule builder☆202Updated this week
- C library for finding and handling crystal symmetries☆345Updated this week
- i-PI: a universal force engine☆281Updated 2 weeks ago
- atomate is a powerful software for computational materials science and contains pre-built workflows.☆260Updated last year
- Periodic table, physical constants, and molecule parsing for quantum chemistry.☆176Updated 2 months ago
- Workflow management for signac-managed data spaces.☆48Updated 4 months ago
- A code to generate atomic structure with symmetry☆346Updated this week
- Manage large and heterogeneous data spaces on the file system.☆136Updated this week
- An open-source Python package for creating fast and accurate interatomic potentials.☆340Updated 3 months ago
- This is a simple script to plot energy profile diagrams using Python and matplotlib.☆178Updated 4 months ago
- Combining Psi4 and Numpy for education and development.☆380Updated last year
- A simulation package of phonon-phonon interaction related properties