Tripartite interaction representation algorithm for crystal graph neural networks
Abstract Driven by emerging research paradigms, the application of artificial intelligence models presents innovative tools for designing materials and optimizing their performance. In the field of materials science, there is a current research emphasis on exploring techniques for characterizing mat...
| Main Authors: | , , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Nature Portfolio
2024-10-01
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| Series: | Scientific Reports |
| Online Access: | https://doi.org/10.1038/s41598-024-76309-w |