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This repo implements a web application utilizing a deep neural network to predict the formation energies and stability of garnet crystals.
Home Page: http://garnetdnn.materialsvirtuallab.org
License: BSD 3-Clause "New" or "Revised" License
Python 56.14%
CSS 4.45%
JavaScript 15.04%
HTML 17.87%
Jupyter Notebook 6.43%
Procfile 0.07%
garnetdnn's People
garnetdnn's Issues
- Implement the latest a-mix model
- Add the option of showing predicted ground state structure, i.e. identifying the lowest energy configuration index.
- Add the option of whether to show the result of calculated entries from calculation or model prediction.
- Clean up