ornlpmcp / ASCENDSLinks
Advanced data SCiEnce toolkit for Non-Data scientists
☆68Updated 2 months ago
Alternatives and similar repositories for ASCENDS
Users that are interested in ASCENDS are comparing it to the libraries listed below
Sorting:
- Fitting thermodynamic models with pycalphad - https://doi.org/10.1557/mrc.2019.59☆77Updated 2 weeks ago
- A Python library to calculate elastic properties of materials.☆59Updated 5 months ago
- NIST Interatomic Potential Repository property calculation tools☆23Updated 4 months ago
- pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.☆46Updated this week
- ELATE: Elastic tensor analysis☆89Updated 3 months ago
- Thermodynamic Phase Diagram Generator☆56Updated 3 years ago
- First-principles statistical mechanical software for the study of multi-component crystalline solids☆123Updated 2 years ago
- A wrapper for many computational codes of thermal conductivity☆27Updated 3 years ago
- Course materials for NANO 106 - Crystallography of Materials☆36Updated 3 years ago
- A kinetic Monte Carlo Python/C++ library.☆132Updated last year
- A framework for processing adsorption data and isotherm fitting☆81Updated 9 months ago
- MAterials Simulation Toolkit for Machine Learning (MAST-ML)☆128Updated 2 months ago
- OpenIEC: An open-source code for interfacial energy calculation in alloys☆39Updated 2 years ago
- A solver for the coupled and decoupled electron and phonon Boltzmann transport equations.☆55Updated last week
- Jupyter notebooks for the Computing and Comunication skills 1st Year Materials Science Course at Manchester☆47Updated 2 years ago
- Density functional theory workflows for finite temperature thermodynamics based on atomate workflows.☆16Updated 2 years ago
- A physics computational framework for python and ipython☆38Updated 5 months ago
- kMC on steroids: A vigorous attempt to make lattice kinetic Monte Carlo modelling easier☆58Updated 7 years ago
- Data Science for Materials Science☆66Updated last week
- A 1D drift-diffusion simulator for semiconductor devices (LEDs, solar cells, diodes, organics, perovskites)☆78Updated 2 weeks ago
- Lattice gas Monte Carlo simulation code☆35Updated 5 years ago
- Fermi surface generation, analysis and visualisation.☆97Updated 3 weeks ago
- Open-source library for analyzing the results produced by ABINIT☆132Updated last week
- Agent-based sequential learning software for materials discovery☆63Updated last year
- A shell script for calculating many interesting materials' parameters for photovoltaic applications, includng Band gap, polarisation☆23Updated 10 years ago
- Generate random alloys and compute various properties☆64Updated last year
- Atomistic Manipulation Toolkit☆94Updated 4 months ago
- SPPARKS Kinetic and Metropolis Monte Carlo simulator☆78Updated 2 months ago
- ☆21Updated last year
- Pymatgen-db provides an addon to the Python Materials Genomics (pymatgen) library (https://pypi.python.org/pypi/pymatgen) that allows the…☆51Updated 3 weeks ago