Crystal-structure design by agentic AI in a language of motifs

arXiv:2608.15900 · cond-mat.mtrl-sci, cs.LG · Submitted 2026-08-16 · Read on arXiv

cond-mat.mtrl-sci, cs.LG

Submitted: 2026-08-16

Updated: 2026-10-21

License: http://arxiv.org/licenses/nonexclusive-distrib/1.0/

Terminology

• Agentic AI — 1× in this paper · explained in 2 episodes

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