Results 181 to 190 of about 17,890 (250)

Conformational Dynamics of Na⁺-Pumping NADH-Quinone Oxidoreductase during Na⁺ Translocation from AlphaFold-Facilitated Markov State Modeling. [PDF]

J Chem Inf Model
Seki T, Ohnuki J, Okazaki KI.
europepmc   +1 more source

LEAD: Literature Enhanced Ab Initio Discovery of Nitride Dusting Layers for Enhanced Tunnel Magnetoresistance and Lower Resistance Magnetic Tunnel Junctions

Advanced Materials, EarlyView.
Magnetic tunnel junctions (MTJs) using MgO tunnel barriers face challenges of high resistance‐area product and low tunnel magnetoresistance (TMR). To discover alternative materials, Literature Enhanced Ab initio Discovery (LEAD) is developed. The LEAD‐predicted materials are theoretically evaluated, showing that MTJs with dusting of ScN or TiN on ...
Sabiq Islam, William S. Rogers, Chen‐Yu Hu, Ming‐Yuan Song, Xinyu Bao, Shehrin Sayed, Jean Anne C. Incorvia   +6 more
wiley   +1 more source

Decoding the Oxygen Reduction Reaction: Mechanistic Insights from Transition Metal Heterostructures. [PDF]

Nanomicro Lett
Sun M, Zhang X, Wang J, Liu J, He J, Ge W, Kong S, Zhang G, Gao M, Wang J, Sun Z, Yan Y, Shi X, Xiao Y.   +13 more
europepmc   +1 more source

Topology and Material Optimization in Ultra‐Soft Magneto‐Active Structures: Making Advantage of Residual Anisotropies

Advanced Materials, EarlyView.
Residual magnetization induces pronounced mechanical anisotropy in ultra‐soft magnetorheological elastomers, shaping deformation and actuation even without external magnetic fields. This study introduces a computational‐experimental framework integrating magneto‐mechanical coupling into topology optimization for designing soft magnetic actuators with ...
Carlos Perez‐Garcia, Rogelio Ortigosa, Jesús Martínez‐Frutos, Daniel Garcia‐Gonzalez   +3 more
wiley   +1 more source

External Stimuli-Activable Single-Atom Nanozymes for Bioapplications. [PDF]

Small
Ko H, Choi J, Noh H, Seo S, Kwon H, Lee S, Lee H.   +6 more
europepmc   +1 more source

Single‐Chromophore Homojunction Organic Solar Cells: A Path to Simplicity and Efficiency

Advanced Materials, EarlyView.
This perspective discusses how the intrinsic optoelectronic properties of organic semiconductors, their molecular packing in the solid‐state, and internal energetic gradients within a device can enable free‐charge carrier generation in homojunction organic solar cells.
Shaun McAnally, Paul L. Burn, Paul E. Shaw   +2 more
wiley   +1 more source

FakeRotLib: Expedient Noncanonical Amino Acid Parametrization in Rosetta. [PDF]

J Chem Inf Model
Bell EW, Brown BP, Meiler J.
europepmc   +1 more source

Self‐Assembled Monolayers in p–i–n Perovskite Solar Cells: Molecular Design, Interfacial Engineering, and Machine Learning–Accelerated Material Discovery

Advanced Materials, EarlyView.
This review highlights the role of self‐assembled monolayers (SAMs) in perovskite solar cells, covering molecular engineering, multifunctional interface regulation, machine learning (ML) accelerated discovery, advanced device architectures, and pathways toward scalable fabrication and commercialization for high‐efficiency and stable single‐junction and
Asmat Ullah, Ying Luo, Stefaan De Wolf
wiley   +1 more source

Progress in the Determination of Resorcinol Using Electrochemical Method. [PDF]

Biosensors (Basel)
Rajkumar C, Ahmad K, Vignesh S, Oh TH.
europepmc   +1 more source

Signatures of Edge States in Antiferromagnetic Van der Waals Josephson Junctions

Advanced Materials, EarlyView.
ABSTRACT The combination of superconductivity and magnetic textures leads to unconventional superconducting phenomena, including new correlated and topological phases. Van der Waals (vdW) materials emerge as a versatile platform for exploring the interplay between these two competing orders.
Celia González‐Sánchez, Ignacio Sardinero, Jorge Cuadra, Alfredo Spuri, José A. Moreno, Hermann Suderow, Elke Scheer, Pablo Burset, Angelo Di Bernardo, Rubén Seoane Souto, Eduardo J. H. Lee   +10 more
wiley   +1 more source