Results 201 to 210 of about 90,750 (294)

Permanent electrostatic moments through the lens of atoms: assessing variational Hirshfeld methods. [PDF]

RSC Adv
van Zyl M, Castillo-Orellana C, Pujal L, Heidar-Zadeh F.   +3 more
europepmc   +1 more source

Deciphering Intricacies in Directional CO2 Conversion From Electrolysis to CO2 Batteries

Advanced Energy Materials, EarlyView.
This review will delve into the inherent connections and distinctions of CO2‐directed conversion in ECO2RR and CO2 batteries, in terms of product types, catalyst selection, catalytic mechanisms, and electrochemical performances, while proposing a benchmarking framework for the evaluation of CO2 batteries and innovative CO2 battery configurations for ...
Changfan Xu, Huaping Zhao, Lizhuang Chen, Weidong Shi, Guosheng Shao, Yong Lei   +5 more
wiley   +1 more source

Spatial interpolation of cropland soil bulk density by increasing soil samples with filled missing values. [PDF]

Sci Rep
Li A, Cheng J, Chen D, Li W, Mao Y, Chen X, Zhao B, Shi W, Yue T, Li Q.   +9 more
europepmc   +1 more source

Adaptive interpolation based on Polya frequency functions [PDF]

, 2008
De Zutter, Daniël, Dhaene, Tom, Knockaert, Luc   +2 more
core   +1 more source

Disorder‐Driven Fast Na+ Transport: From Crystalline to Amorphous Networks in the Mixed‐Anion NaTaOxCl6−2x Oxychlorides

Advanced Energy Materials, EarlyView.
Oxygen substitution in NaTaOxCl6‐2x drives structural evolution from isolated [TaCl6]– octahedra, through oxygen‐bridged [Ta2OCl10]2– dimers, toward extended trans‐[TaO2Cl4]3– chain‐like arrangements. At intermediate compositions, zero‐dimensional corner‐sharing motifs are proposed to create a flexible, disordered framework that peaks ionic ...
Justin Leifeld, Abigail C. Parsons, Alexandra Morscher, Xabier Martinez de Irujo‐Labalde, Marvin A. Kraft, Oskar G. Soulas, Bibek Samanta, Wiebke Zielasko, Neelam Yadav, Kyra Strotmann, Niina Jalarvo, Bruno V. M. Rodrigues, Adam Slabon, Philipp Adelhelm, Michael Ryan Hansen, David O. Scanlon, Wolfgang G. Zeier, Alexander G. Squires   +17 more
wiley   +1 more source

High-Order Exponentially Fitted Methods for Accurate Prediction of Milling Stability. [PDF]

Micromachines (Basel)
Wu Y, Deng B, Zhao Q, Ye T, Liu A, Jiang W.   +5 more
europepmc   +1 more source

Reaction kinetics model in liquid and solid phases and its parameterization for room temperature sodium–sulfur battery

AIChE Journal, EarlyView.
Abstract A multipore, multiphase, continuum model is assembled for the first time for room temperature sodium–sulfur (RT Na–S) batteries, with Na+ ion transport and redox reactions in the liquid electrolyte phase and semisolid phase of precipitates softened by the electrolyte solvent, as guided by molecular dynamics simulations in this study ...
Hakeem A. Adeoye, Allan Foster, John F. Watts, Constantina Lekakou   +3 more
wiley   +1 more source

Peridynamics-Based Finite Element Analysis of Sealing Failure at Casing-Cement Sheath Interfaces in Ultra-Deep Wells. [PDF]

ACS Omega
Zhai S, Feng B, Zhao S, Li D, Cai C, Zhao X.   +5 more
europepmc   +1 more source

Toward Knowledge‐Guided AI for Inverse Design in Manufacturing: A Perspective on Domain, Physics, and Human–AI Synergy

Advanced Intelligent Discovery, EarlyView.
This perspective highlights how knowledge‐guided artificial intelligence can address key challenges in manufacturing inverse design, including high‐dimensional search spaces, limited data, and process constraints. It focused on three complementary pillars—expert‐guided problem definition, physics‐informed machine learning, and large language model ...
Hugon Lee, Hyeonbin Moon, Junhyeong Lee, Seunghwa Ryu   +3 more
wiley   +1 more source