Results 131 to 140 of about 205,731 (294)

A Super‐Adhesive Air Filter With Capillarity‐Mediated Spontaneous Particle Absorption via Dynamic Bond Exchange

Advanced Materials, EarlyView.
We address the inherently weak particle adhesion of conventional air filters by coating a dynamically crosslinked adhesive layer that delivers capillarity‐driven strong adhesion and particle absorption mediated by dynamic bond exchange. The resulting enhancement in particle adhesion enables efficient ultrafast (up to 20 m s−1) and omnidirectional ...
Junyong Park, Hyeri Jeon, Hyunwoong Park, Ji Min Lee, Yeomyung Yoon, Gyeong Hwan Choi, Sazzadul A. Rahat, Dong Wook Lee, Sohdam Jeong, Jonathan T. Pham, Chae Bin Kim, Sanghyuk Wooh   +11 more
wiley   +1 more source

Vibrational-mechanical properties of the highly-mismatched Cd_1-xBe_xTe semiconductor alloy: experiment and ab initio calculations. [PDF]

Sci Rep, 2023
Elmahjoubi A, Shoker MB, Pagès O, Torres VJB, Polian A, Postnikov AV, Bellin C, Béneut K, Gardiennet C, Kervern G, En Naciri A, Broch L, Hajj Hussein R, Itié JP, Nataf L, Ravy S, Franchetti P, Diliberto S, Michel S, Abouais A, Strzałkowski K.   +20 more
europepmc   +1 more source

Inert Catalytic Sites Unlocked by Micropollutants for Rapid Water Decontamination with Near‐Complete Chemical Utilization

Advanced Materials, EarlyView.
Micropollutants can act as molecular triggers that activate a newly designed and chemically inert Fenton‐like PKU‐24 catalyst for on‐demand singlet oxygen generation from peroxymonosulfate (PMS), enabling nearly complete peroxide utilization and selective micropollutant removal from complex real‐world wastewater.
Yu‐Hang Li, Mingyi Liu, Yuanhao Li, Yaran Bai, Fu‐Xue Wang, Xiaoyi Hu, Xiaoguang Duan, Haodong Ji   +7 more
wiley   +1 more source

Polar GaN Surfaces under Gallium Rich Conditions: Revised Thermodynamic Insights from Ab Initio Calculations. [PDF]

Materials (Basel), 2023
Kempisty P, Kawka K, Kusaba A, Kangawa Y.   +3 more
europepmc   +1 more source

Ab-Initio Calculations of TMO Band Structure

, 2018
We review the fundamental aspects related to ab-initio band structure calculations for the SrTiO 3/LaAlO 3 interface, analyzing capabilities and limits of the most advanced approaches, using available experiments as a reference. In particular, we discuss accuracy and failures for what concern the description of electronic, transport, and thermoelectric
openaire   +2 more sources

Coupled Chemical and Mechanical Control of the Pore Size in Carbon Honeycomb Membranes for Water Desalination

Advanced Materials Interfaces, EarlyView.
ABSTRACT The advancement of 3D carbon nanostructures for next‐generation desalination membranes is hindered by limited control of the pore size to ensure effective salt rejection. Chemical functionalization and mechanical modification are known approaches to address the problem, while the combined effect of the two approaches remains unexplored.
Aleksandr S. Voronin, Duc Tam Ho, Udo Schwingenschlögl   +2 more
wiley   +1 more source

Benchmark Study of the Electronic States of the LiRb Molecule: Ab Initio Calculations with the Fock Space Coupled Cluster Approach. [PDF]

Molecules, 2023
Skrzyński G, Musial M.
europepmc   +1 more source

Molecular‐Level Insights into Interfacial Adsorption Mechanisms of PFOA on Functional Dolomite Surfaces via AIMD and Spectroscopy

Advanced Materials Interfaces, EarlyView.
Perfluorooctanoic acid (PFOA), ab initio molecular dynamics (AIMD), density functional theory (DFT), Dolomite (DL), metal‐organic frameworks (MOFs), calcined modified dolomite (CDL), zero‐point of charge (PZC), metal‐organic frameworks (MOFs), Fourier transform infrared (FTIR), X‐ray diffraction (XRD), scanning electron microscopy (SEM ...
Yating Yang, Yuhan Li, Zhaohui Li, Hang Wei, Yaqi Wen, Po‐Hsiang Chang, Christopher Rensing, Ahmed I. Osman, Baoyu Kong   +8 more
wiley   +1 more source

Powder‐to‐Film Conversion of Nickel Single‐Atom Catalysts into Binder‐Free and Resistant Electrodes

Advanced Materials Interfaces, EarlyView.
A reproducible strategy is reported for fabricating standalone thin‐film electrodes composed of CNx‐supported Ni single‐atom catalysts. The resulting binder‐free electrodes exhibit robust stability, enhanced charge transfer, and superior electrochemical performance, offering scalable opportunities for applications in electrochemistry. ABSTRACT Although
Milla Vigliengo, Nicolò Allasia, Shuting Xiang, Yurii P. Ivanov, Riccardo Gulminelli, Martin Sterrer, Giorgio Divitini, Anatoly I. Frenkel, Gianvito Vilé   +8 more
wiley   +1 more source

Wafer‐Scale Single‐Crystal Boron Nitride: Synthesis and Integration in 2D Electronics

Advanced Materials Interfaces, EarlyView.
This Review highlights recent breakthroughs in wafer‐scale hBN synthesis and its integration into next‐generation 2D electronics. We analyze growth kinetics, epitaxial strategies, and stacking‐sequence control while correlating material quality with device performance.
Jaewon Wang, Soon‐Yong Kwon
wiley   +1 more source