drcassar / glasspyLinks
Python module for scientists working with glass materials
☆33Updated 2 months ago
Alternatives and similar repositories for glasspy
Users that are interested in glasspy are comparing it to the libraries listed below
Sorting:
- The database contains a vast set of data on the properties of glass materials.☆43Updated 6 years ago
- Python library written in C++ for calculation of local atomic structural environment☆68Updated last year
- Machine Learning Package Targeted for Amorphous Materials.☆20Updated 4 years ago
- A Python library and command line interface for automated free energy calculations☆82Updated 2 weeks ago
- Automatic generation of crystal structure descriptions.☆125Updated 2 weeks ago
- The database contains a vast set of data on the properties of glass materials.☆14Updated 2 years ago
- Statistical Mechanics on Lattices☆88Updated last week
- MPmorph is a collection of tools to run and analyze ab-initio molecular dynamics (AIMD) calculations run with VASP, and is currently unde…☆74Updated last year
- A machine learning environment for atomic-scale modeling in surface science and catalysis.☆116Updated last year
- Python script to plot periodic trends as a heat map over the periodic table of elements☆106Updated last month
- ☆21Updated 5 years ago
- updated constant potential plugin for LAMMPS☆39Updated 2 years ago
- Python Materials Discovery Framework☆75Updated last year
- Pymatgen-db provides an addon to the Python Materials Genomics (pymatgen) library (https://pypi.python.org/pypi/pymatgen) that allows the…☆51Updated last month
- Derivative structure enumeration library☆78Updated 10 months ago
- Machine Learning Interatomic Potential Predictions☆93Updated last year
- Atomistic Manipulation Toolkit☆91Updated 2 months ago
- A module for ASE for elastic constants calculation.☆46Updated 8 months ago
- ☆22Updated 3 years ago
- The QMOF Database: A database of quantum-mechanical properties for metal-organic frameworks.☆150Updated 4 months ago
- General purpose tools for high-throughput catalysis☆96Updated 4 months ago
- The Wren sits on its Roost in the Aviary.☆60Updated 2 months ago
- data and code to reduplicate paper: Topological representations of crystalline compounds for the machine-learning prediction of materials…☆21Updated 4 years ago
- Active learning workflow developed as a part of the upcoming article "Machine Learning Inter-Atomic Potentials Generation Driven by Activ…☆28Updated 3 years ago
- Generating Deep Potential with Python☆69Updated 3 weeks ago
- pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LA…☆70Updated 4 months ago
- A Python library for building atomic neural networks☆117Updated 5 months ago
- A simulation package of phonon-phonon interaction related properties☆145Updated last week
- A physics computational framework for python and ipython☆38Updated 2 months ago
- Analysis of quantum chemical interactions in molecules and solids.☆110Updated last week