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Jonggeol Na

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#artificial intelligence Preprint Oct 2026

MOF-VERIFY: A Failure-Aware Agentic Harness for MOF Hypothesis Verification

Large language models are increasingly used as reasoning components in AI-driven materials Co-Scientists, yet the reliability of the resulting verification pipeline remains unclear. Metal-organic frameworks (MOFs) provide a particularly challenging setting because structures may appear under different identifiers, synt...

Donghyun Lee, Taehoon Lee, G. Ahn et al. · 0 citations
Preprint Sep 2026

Reliability Value of Long-Duration Energy Storage against Extreme Events in High-Renewable Grids: A Full-Year AC-OPF Assessment

Long-duration energy storage (LDES) can mitigate prolonged renewable--load imbalances during Dunkelflaute events, but existing studies rely on zonal or linearized DC network models and inadequately analyze the operational feasibility of the grid across a wide range of full-year renewable, load, and contingency scenario...

Jeongdong Kim, Jonggeol Na, Sung-Ho Shin · 0 citations
Preprint Jul 2026

CatRetriever: Contrastive Representation Learning for Slab-to-Bulk Retrieval in Generative Catalyst Discovery

CatRetriever provides a scalable route for connecting catalyst generative models with physically plausible and adsorption energy compatible bulk catalyst discovery, and is extended into an adsorption energy targeted bulk discovery pipeline that combines bulk retrieval, generative search space expansion, and adsorption...

Jungho Oh, Woosung Kim, Dong Hyeon Mok et al. · 0 citations
Preprint Jul 2026

Catalyst Diffusion Transformer: Generative Inverse Design of Heterogeneous Catalysts

CatDiT is presented, a unified framework for inverse catalyst design that generates valid and novel structures ranging from intermetallic alloys to oxide surfaces and establishes CatDiT as a practical and scalable approach for property-directed catalyst inverse design and targeted catalyst generation.

Hayoung Doo, Dong Hyeon Mok, S. Back et al. · 0 citations

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