Search Results - "Fragapane NL"

Li-P-S Electrolyte Materials as a Benchmark for Machine-Learned Interatomic Potentials.

Authors: Fragapane NL Deringer VL

Source: Journal of chemical theory and computation [J Chem Theory Comput] 2026 Apr 14; Vol. 22 (7), pp. 3646-3659. Date of Electronic Publication: 2026 Mar 18.

Publication Type: Journal Article

Journal Info: Publisher: American Chemical Society Country of Publication: United States NLM ID: 101232704 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-9626 (Electronic) Linking ISSN: 15499618 NLM ISO Abbreviation: J Chem Theory Comput Subsets: MEDLINE; PubMed not MEDLINE

An automated framework for exploring and learning potential-energy surfaces.

Authors: Liu Y Morrow JD Ertural C et al.

Source: Nature communications [Nat Commun] 2025 Aug 18; Vol. 16 (1), pp. 7666. Date of Electronic Publication: 2025 Aug 18.

Publication Type: Journal Article

Journal Info: Publisher: Nature Pub. Group Country of Publication: England NLM ID: 101528555 Publication Model: Electronic Cited Medium: Internet ISSN: 2041-1723 (Electronic) Linking ISSN: 20411723 NLM ISO Abbreviation: Nat Commun Subsets: MEDLINE; PubMed not MEDLINE