Total Magnetization

2 papers with code • 2 benchmarks • 2 datasets

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Libraries

Use these libraries to find Total Magnetization models and implementations
2 papers
98

Most implemented papers

Crystal Graph Neural Networks for Data Mining in Materials Science

Tony-Y/cgnn Technical report, RIMCS LLC 2019

This paper proposes crystal graph neural networks (CGNNs) that use no bond distances, and introduces a scale-invariant graph coordinator that makes up crystal graphs for the CGNN models to be trained on the dataset based on a theoretical materials database.

OQM9HK: A Large-Scale Graph Dataset for Machine Learning in Materials Science

Tony-Y/cgnn Technical report, RIMCS LLC 2022

We introduce a large-scale dataset of quantum-mechanically calculated properties of crystalline materials for graph representation learning that contains approximately 900k entries (OQM9HK).