costrouc / mse-machinelearning-notebooks

Related projects ⓘ

Alternatives and complementary repositories for mse-machinelearning-notebooks

• uw-cmg / MAST-ML
  MAterials Simulation Toolkit for Machine Learning (MAST-ML)
  ☆106Updated last month
• pyiron / pyiron_atomistics
  pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.
  ☆44Updated this week
• romerogroup / MechElastic
  A Python library to calculate elastic properties of materials.
  ☆53Updated 2 years ago
• CitrineInformatics / python-citrination-client
  Reference implementation in python for Citrination api
  ☆14Updated 3 years ago
• Kaaiian / Houston_ML_in_MSE_workshop
  Code to help you get started using machine learning in materials science
  ☆15Updated 5 years ago
• MaterialsDiscovery / PyChemia
  Python Materials Discovery Framework
  ☆71Updated 9 months ago
• materialsvirtuallab / nano106
  Course materials for NANO 106 - Crystallography of Materials
  ☆33Updated 2 years ago
• abinit / abipy
  Open-source library for analyzing the results produced by ABINIT
  ☆116Updated this week
• WMD-group / SMACT
  Python package to aid materials design and informatics
  ☆100Updated this week
• lanl / MILK
  MAUD Interface Language Kit (MILK) is a set of Rietveld tools for automated processing of diffraction datasets.
  ☆18Updated this week
• SergeiVKalinin / MSE_Fall2023
  The materials for the Fall ML in Materials course at the UTK MSE
  ☆82Updated 11 months ago
• CCP-NC / soprano
  Soprano - a Python library to crack crystals!
  ☆9Updated last month
• kayahans / qmc-dft-python
  Educational code for Density Functional Theory and Quantum Monte Carlo with Python
  ☆18Updated 5 years ago
• usnistgov / feasst
  The Free Energy and Advanced Sampling Simulation Toolkit (FEASST) is a free and open-source software to conduct molecular- and particle-b…
  ☆33Updated last week
• blaiszik / Materials-Databases
  ☆79Updated 9 years ago
• materialsvirtuallab / nano281
  Data Science for Materials Science
  ☆58Updated 9 months ago
• WMD-group / ASE-Tutorials
  Examples of using the Atomic Simulation Environment
  ☆30Updated 8 years ago
• usnistgov / atomman
  Atomistic Manipulation Toolkit
  ☆80Updated 6 months ago
• AI-multimodal / Lightshow
  A one-stop-shop for handling data in computational spectroscopy
  ☆14Updated this week
• Andrew-S-Rosen / periodic_trends
  Python script to plot periodic trends as a heat map over the periodic table of elements
  ☆87Updated last year
• CitrineInformatics / MPEA_dataset
  Expanded dataset of mechanical properties and observed phases of multi-principal element alloys
  ☆31Updated 2 years ago
• usnistgov / iprPy
  NIST Interatomic Potential Repository property calculation tools
  ☆21Updated 6 months ago
• JARVIS-Materials-Design / jarvis-tools-notebooks
  A Google-Colab Notebook Collection for Materials Design: https://jarvis.nist.gov/
  ☆67Updated 3 months ago
• ncfrey / resources
  A Highly Opinionated List of Open Source Materials Informatics Resources
  ☆123Updated 2 years ago
• ncfrey / pytopomat
  Python Topological Materials (pytopomat) is a code for easy, high-throughput analysis of topological materials.
  ☆27Updated 3 years ago
• TRI-AMDD / CAMD
  Agent-based sequential learning software for materials discovery
  ☆60Updated 9 months ago
• CitrineInformatics / learn-citrination
  Training materials
  ☆22Updated 4 years ago
• hackingmaterials / robocrystallographer
  Automatic generation of crystal structure descriptions.
  ☆103Updated last week
• phonopy / phono3py
  A simulation package of phonon-phonon interaction related properties
  ☆125Updated this week
• materialsproject / emmet
  Be a master builder of databases of material properties. Avoid the Kragle.
  ☆55Updated this week