Results 141 to 150 of about 123,035 (268)

BACH, a Bayesian Optimization Protocol for Accurate Coarse‐Grained Parameterization of Organic Liquids

Advanced Functional Materials, EarlyView.
We present a fully automated Bayesian optimization (BO) protocol for the parameterization of nonbonded interactions in coarse‐grain CG force fields (BACH). Using experimental thermophysical data, we apply the protocol to a broad range of liquids, spanning linear, branched, and unsaturated hydrocarbons, esters, triglycerides, and water.
Janak Prabhu, Akhil Pratap Singh, Pablo Campomanes, Stefano Vanni   +3 more
wiley   +1 more source

Soil health boundaries for navigating agricultural trade-offs. [PDF]

Eco Environ Health
Wang G, Cheng S, Li T, Zhou Q.
europepmc   +1 more source

Engineering Strategies for Stable and Long‐Life Alkaline Zinc‐Based Flow Batteries

Advanced Functional Materials, EarlyView.
Alkaline zinc‐based flow batteries face persistent challenges from unstable zinc deposition, including dendrite growth, passivation, corrosion, and hydrogen evolution, which severely limit cycling stability. Current research addresses these issues through coordinated electrode structuring, electrolyte regulation, and membrane design to control zinc ...
Yuran Bai, Xiaoyu Huo, Xin Long, Enkang Fu, Xusong Gong, Lei Wei, Liang An   +6 more
wiley   +1 more source

Carbon mitigation effect of service trade innovation: quasi-experimental evidence from China. [PDF]

Carbon Balance Manag
Yu Y, Cai Y, Huang X, Zhang Z.
europepmc   +1 more source

Single‐ and Dual‐Atom Configurations in Atomically Dispersed Catalysts for Lithium–Sulfur Batteries

Advanced Functional Materials, EarlyView.
Single‐atom and dual‐atom‐based atomically dispersed catalysts (ADCs) effectively address the shuttle effect and sluggish redox kinetics in Li–S batteries. With nearly 100% atomic utilization and tunable coordination environments, ADCs enhance LiPSs adsorption, lower conversion barriers, and accelerate sulfur redox reactions.
Haoyang Xu, Zhenfeng Li, Yue Fei, Ali Mohammadi, Ge Li   +4 more
wiley   +1 more source

Pareto-Front Optimization of Variance-Added Expected Loss with Interrelated Qualities. [PDF]

Entropy (Basel)
Kim S, Lee K.
europepmc   +1 more source

Auxeticity‐by‐Assembly: Interlocking Modular Auxetic Metamaterials with Selectively Activatable AgNW–Graphene Oxide‐EGaIn Composite Interconnects for Scalable Freeform Photovoltaic Modules

Advanced Functional Materials, EarlyView.
Auxeticity‑by‑Assembly converts freeform photovoltaics from cut‑defined layouts to assembly‑defined systems. Standardized interlocking units generate negative‑Poisson‑ratio, reconfigurable architectures, while hinge regions are wired by selectively activatable AgNW–GO@EGaIn composite interconnects and a folding‑enabled interconnector layer. A decimeter‑
Seok Joon Hwang, Jiwon Ryu, Dae‐Hee Cho, YoungHoi Cho, Yewon Hwang, Haram Lee, Dong Hoe Kim, Byeong‐Kwon Ju, Seok Chung, Deokjae Choi, Gee Yeong Kim, Heesuk Jung, Taehee Kim, Hyeonggeun Yu, Gabseok Seo, Phillip Lee   +15 more
wiley   +1 more source

Navigating Opportunities and Challenges in Large-Scale Longitudinal Electroencephalography Studies. [PDF]

Biol Psychiatry Glob Open Sci
Franken IHA, Boer OD, El Marroun H.
europepmc   +1 more source

Constructing Ionic Fast Diffusion Channels on LiNi0.5Mn1.5O4 for Lithium‐Ion Batteries

Advanced Functional Materials, EarlyView.
A dual‐modification strategy is developed for LNMO cathode, where bulk Ti doping stabilizes the oxygen framework and simultaneously drives the in situ formation of LaTi2O6 nano‐islands as ion diffusion channels on (111) surfaces, enabling high‐rate capacity (∼100 mAh g−1 at 30 C) and excellent cycling retention (87.8% after 1000 cycles).
Xinyi Zhang, Sicheng Wu, Xuzhao Liu, Haocheng Guo, Jian Peng, Xia Huang, Xiaobo Zhu, Yuhui Ge, Haochen Lu, Shuhao Wang, Lianzhou Wang   +10 more
wiley   +1 more source

Global marine fish trade networks track international pathways of nutrients and contaminants. [PDF]

Eco Environ Health
Zhu Y, Ho QT, Robinson JPW, Kjellevold M, Chang R, Fuglebakk E, Ma J, Song S, Dahl L, Nøstbakken OJ, Markhus MW, Nilsen BM, Kögel T, Lundebye AK, Azad AM, Uzomah A, Kolding J, Lien VS, Wiech M, Zhang Y, Maage A, Frøyland L, Bank MS.   +22 more
europepmc   +1 more source