Published 2026 | Version v2
Model Open

Goldilocks CGCNN representation model

  • 1. UKRI STFC

Description

A crystal graph convolutional neural network classifier used by Goldilocks to estimate whether a periodic material is metallic. It was trained against Materials Project is_metal labels from an October 2025 snapshot. Class 0 denotes insulator and class 1 denotes metal.

The record includes the PyTorch Lightning checkpoint, its atom embedding table, and sidecar documentation containing the graph feature contract and checksums.

Files

README.md

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