Services
Research infrastructure
- Materials dataset construction
- Building an extensible data foundation for structures, properties and calculations with clear sources and consistent fields.
- Benchmark evaluation engineering
- Defining tasks, constructing splits, checking leakage, reproducing baselines and testing physical validity so model comparisons remain inspectable and repeatable.
- Topological materials computation
- Theoretical calculations on the classification, symmetry protection and phase transitions of emerging Weyl semimetals.
Workflow
- Collect
- Retain data sources, calculation settings and raw records.
- Standardise
- Align structures, properties, units and metadata.
- Benchmark
- Define tasks, baselines, splits and valid denominators.
- Validate
- Check physical consistency, reproducibility and failure cases.