AtomGPT & AGAPI Generative and agentic AI for materials design BatteryMat ML-accelerated DFT screening of battery cathodes SlaKoNet DB ML electronic-property prediction at scale (poster at ESW) CatalysisMat Learning adsorption energies for catalyst discovery DiffractGPT-Rietveld Automated crystal structure determination from powder XRD RamanGPT Bidirectional ML between crystal structures and Raman spectra SlaKoNet-VQD Variational quantum band structures from neural tight-binding Hamiltonians GPU Scaling for Materials Benchmarking DFT & ML force fields on Blackwell GPUs Hallucination Detector LLM and Semantic Scholar citation verification for scientific literature
