Results 101 to 110 of about 161,383 (266)
Through a systematic and comprehensive analysis of the environmental impacts for the emerging MXene synthesis pathways, this study presents process transformation and optimization opportunities for low‐carbon MXene production from laboratory to industrial scales.
Yushuai Huang +6 more
wiley +1 more source
Phase‐resolved experiments and atomistic simulations reveal asynchronous ordering behaviors in a eutectic high‐entropy alloy during isothermal annealing. Distinct defect transport mechanisms are identified in coexisting B2 and BCC phases, showing that vacancy and interstitial mediated diffusion governs phase‐dependent thermal stability.
Huiwen Yao +5 more
wiley +1 more source
Impedance of Nonelectroneutral Solid Electrolyte Interphases With Nanopores: A Theoretical Model
Physical modeling reveals that often‐neglected non‐electroneutrality and nanopores in the solid‐electrolyte interphase (SEI) govern the impedance behavior. Under nonreactive conditions, the low‐frequency constant‐phase element (CPE) phenomenon can be attributed to the nonelectroneutral local conditions in the SEI.
Chenkun Li, Jun Huang
wiley +1 more source
SMarT‐Diff introduces a multi‐objective generative paradigm that integrates scaffold hopping with structure‐aware scoring to enable controlled exploration beyond the training distribution. The framework consistently balances drug‐likeness, synthesizes accessibility and bioactivity, yielding chemically diverse candidates with enhanced properties.
Yuwei Yang +8 more
wiley +1 more source
Investigations of Water Transport in Shale Reservoir with Dual-Wettability by Using Monte Carlo Method. [PDF]
Liang T, Fan W, Yu B, Yang C, Qu M.
europepmc +1 more source
Superlattice Architectures for Advancing Photothermal Catalysis: Mechanisms and Applications
This paper provides a timely overview of superlattice architectures in photothermal catalysis, with a systematic review on mechanisms at both atomic and macroscopic scales in different processes, challenges, and future opportunities. ABSTRACT Photothermal catalysis has emerged as a powerful strategy to complement photocatalysis by harnessing full ...
Yuzhao Wu +5 more
wiley +1 more source
Determination of the detection efficiency of in thiroid using Monte Carlo method
Monte Carlo Method was the base to estimate the detection efficiency of of the identiFINDER ultra detector in “thyroid” geometry. The suitability of the calibration methodology is discussed using a comparison of the results of the Direct Monte Carlo ...
Dayana Ramos Machado +3 more
doaj
A Monte Carlo Method for Calculating Lynden-Bell Equilibrium in Self-Gravitating Systems. [PDF]
Teles TN, Farias CAF, Pakter R, Levin Y.
europepmc +1 more source
Enhanced Stability in Zero‐Excess Li‐Metal Batteries via Prelithiated Carbon Nanofiber Interlayers
Carbon nanofibers carbonized at 700°C show Li metal deposition predominantly on the side facing the Cu current collector. During delithiation, Li agglomerates remain as inactive lithium on the fiber surface. This behavior can be changed by a modified n‐Buli prelithiation without a washing step, suppressing dead Li formation and therefore enabling ...
Sandro Schöner +11 more
wiley +1 more source
A Data‐Driven Inverse Design Methodology for Magnetic Soft Millirobots Navigating in Confined Spaces
A data‐efficient inverse design framework automates the optimization of magnetic soft millirobots for confined‐space navigation. Integrating a physics‐based Cosserat rod model with Bayesian optimization efficiently identifies high‐performance geometries.
Ziyu Ren +5 more
wiley +1 more source

