Results 141 to 150 of about 11,878 (257)

Redox Complexity in Sodium Manganese Hexacyanomanganate and Its Influence on Sodium‐Ion Storage Performance

Advanced Energy Materials, EarlyView.
The role of each Mn site in the Na3‐xMn[Mn(CN)6]·zH2O compounds’ redox activity was investigated using a combined experimental–computational approach, which shows that only the low‐spin Mn‐C site undergoes redox changes (Mn1+ to Mn4+), while high‐spin Mn‐N remains unchanged. The study confirms the presence of the Mn1+ intermediate and newly reveals its
Zhenying Li, Nilanka M. Keppetipola, Yu Wang, Gwenaëlle Rousse, Romain Dugas, Anatolii V. Morozov, Artem M. Abakumov, Héloïse Pages, Mouna Ben Yahia, Marie‐Liesse Doublet, Ozlem Sel, Jean‐Marie Tarascon   +11 more
wiley   +1 more source

The <i>H_trs-T_trs</i> Function of Phase Transition Enthalpy for Chemical Elements and Inorganic and Organic Compounds. [PDF]

ACS Phys Chem Au
Cheng Y.
europepmc   +1 more source

Competition Policy and Agribusiness in the Biden Administration

Applied Economic Perspectives and Policy, EarlyView.
ABSTRACT The Biden Administration pursued a set of ambitious competition policy initiatives in agriculture and agribusiness, primarily aimed at livestock and poultry supply chains, farm inputs, and food retailing. The initiatives included expanded antitrust enforcement; new US Department of Agriculture (USDA) contract regulations requiring poultry ...
James M. MacDonald
wiley   +1 more source

Two-Dimensional Porous Beryllium Trinitride Monolayer as Multifunctional Energetic Material. [PDF]

Nanomaterials (Basel)
Jiang J, Hu Q, Wang W, Guo H.
europepmc   +1 more source

Access to Finance and Innovation in the Canadian Food Processing

Agribusiness, EarlyView.
ABSTRACT Innovation is a presumed channel through which finance affects productivity, yet there is limited research testing the relationship between finance and innovation in the food manufacturing sector. The purpose of the paper is to explore the determinants (e.g., financing, R&D, firm size, expenditure on innovation) of the adoption of innovation ...
Getu Hailu, Deepananda Herath
wiley   +1 more source

Methane Beryllation Catalyzed by a Base Metal Complex. [PDF]

J Am Chem Soc
Boronski JT, Crumpton AE, Struijs JJC, Aldridge S.   +3 more
europepmc   +1 more source

Large Language Model in Materials Science: Roles, Challenges, and Strategic Outlook

Advanced Intelligent Discovery, EarlyView.
Large language models (LLMs) are reshaping materials science. Acting as Oracle, Surrogate, Quant, and Arbiter, they now extract knowledge, predict properties, gauge risk, and steer decisions within a traceable loop. Overcoming data heterogeneity, hallucinations, and poor interpretability demands domain‐adapted models, cross‐modal data standards, and ...
Jinglan Zhang, Xinyi Chen, Xu Ye, Yulin Yang, Bin Ai   +4 more
wiley   +1 more source

Comparison of DeePMD, MTP, GAP, ACE and MACE Machine‐Learned Potentials for Radiation‐Damage Simulations: A User Perspective

Advanced Intelligent Discovery, EarlyView.
The authors evaluated six machine‐learned interatomic potentials for simulating threshold displacement energies and tritium diffusion in LiAlO2 essential for tritium production. Trained on the same density functional theory data and benchmarked against traditional models for accuracy, stability, displacement energies, and cost, Moment Tensor Potential ...
Ankit Roy, Ram Devanathan, Sarah Allec, Giridhar Nandipati, Andrew M. Casella, David J. Senor, Duane D. Johnson, Ganesh Balasubramanian, Ayoub Soulami   +8 more
wiley   +1 more source

Phase Evolution and Synthesis of Be₁₂ Nb Intermetallic Compound in the 800-1300 °C Temperature Range. [PDF]

Materials (Basel)
Udartsev S, Kenzhina IE, Kulsartov T, Samarkhanov K, Zaurbekova Z, Ponkratov Y, Yelishenkov A, Begentayev M, Askerbekov S, Tolenova A, Kylyshkanov M, Podoinikov M, Kaynazarova A, Obgolts O.   +13 more
europepmc   +1 more source

Interpretability and Representability of Commutative Algebra, Algebraic Topology, and Topological Spectral Theory for Real‐World Data

Advanced Intelligent Discovery, EarlyView.
This article investigates how persistent homology, persistent Laplacians, and persistent commutative algebra reveal complementary geometric, topological, and algebraic invariants or signatures of real‐world data. By analyzing shapes, synthetic complexes, fullerenes, and biomolecules, the article shows how these mathematical frameworks enhance ...
Yiming Ren, Guo‐Wei Wei
wiley   +1 more source