Results 131 to 140 of about 147,636 (266)

Interface Engineering via Sb2Te3 Deposition Enables High‐Performance SWCNT Film Thermoelectrics

Advanced Functional Materials, EarlyView.
SWCNTs are promising for flexible thermoelectrics but suffer from low performance. Here, cold‐pressed SWCNT films combined with deposited Sb2Te3 form engineered interfaces that enhance charge transport and energy filtering. The composite achieves a high power factor (25.82 µW cm−1 K−2) and delivers a power density of 3 mW cm−2 at ΔT = 40 K, with ...
Yuan‐Meng Liu, Xiao‐Lei Shi, Ziyu Wang, Muyang Huang, Meng Li, Xiaolong Sun, Yong Liu, Shanshan Zhou, Yi Zhao, Yineng Gou, Yue Hou, Zhi‐Gang Chen   +11 more
wiley   +1 more source

Exploring epidemic control policies using nonlinear programming and mathematical models. [PDF]

PLoS Comput Biol
Montes-Olivas S, Kucharski AJ, Gravenor MB, Frost SDW.   +3 more
europepmc   +1 more source

Methods of computational algebraic geometry in higher dimensional systems theory

Expositions of current mathematics, 2005
openaire   +1 more source

Graphene Quantum Dot‐Induced Microstrain for Framework Stabilization of High‐Entropy Prussian Blue Analog in High‐Current Alkaline Hydrogen Evolution Reaction

Advanced Functional Materials, EarlyView.
The intrinsic distortion‐rich lattice of HEPBA with GQD‐enabled microstrain engineering establishes a mechanistic route toward high‐performance alkaline hydrogen evolution reaction. HEPBA inherently feature heterogeneous local coordination environments arising from multimetal incorporation, while properly introducing GQD during coprecipitation ...
Mia Rinawati, Yu‐Ru Liu, Wei‐Hsiang Huang, Kuan‐Yu Lin, Ching‐Ju Ho, Ling‐Yu Chang, Karel Roubik, Ni Luh Wulan Septiani, Ahmad Nuruddin, Wei‐Nien Su, Min‐Hsin Yeh   +10 more
wiley   +1 more source

Transfer Learning Meets Embedded Correlated Wavefunction Theory for Chemically Accurate Molecular Simulations: Application to Calcium Carbonate Ion Pairing. [PDF]

J Chem Theory Comput
Bian X, Carter EA.
europepmc   +1 more source

Mechanistic Control of C─H Bond Activation and C─C Coupling in Light‐Driven Methane Conversion to C2+ Products over Multifunctional Photocatalysts

Advanced Functional Materials, EarlyView.
Methane photocatalytic activation under mild conditions remains a formidable challenge in the synthesis of solar fuels. In this review, we emphasize the growing importance of multifunctional materials and hybrid systems within a unified mechanistic framework that integrates selective C─H bond activation, formation and control of intermediates, C─C ...
Di Hu, Yuheng Jiang, Vitaly V. Ordomsky, Bastian Mei, Zhiyong Tang, Andrei Y. Khodakov   +5 more
wiley   +1 more source

Molecular Quantum Computations on a Protein. [PDF]

J Chem Theory Comput
Shajan A, Kaliakin D, Liang F, Pellegrini T, Doga H, Bhowmik S, Das S, Mezzacapo A, Motta M, Merz KM.   +9 more
europepmc   +1 more source

Biomimetic Microfractals Based Flexible Triboelectric Nanogenerators

Advanced Functional Materials, EarlyView.
A leaf‐skeleton‐based microfractal architecture is integrated with guided CuNW networks and biomimetic triboelectric polymer layers, enabling breathable, flexible, and material‐efficient triboelectric nanogenerators. The resulting system combines enhanced charge generation and charge transport, offering potential for next‐generation self‐powered ...
Amit Barua, Mislav Matić, Ana‐Marija Pitner, Rituporn Gogoi, Aman Kumar, Mirko Poljak, Anastasia Koivikko, Vipul Sharma   +7 more
wiley   +1 more source

Analysis of Influencing Factors in Quantum Chemistry Simulation Based on VQE Algorithm. [PDF]

Entropy (Basel)
Zhang M, Kang J, Wu Q, Han B.
europepmc   +1 more source

Si‐Doped Nanocrystalline Diamond as Highly Sensitive Luminescence Thermometer for the Physiological Temperature Range

Advanced Functional Materials, EarlyView.
In this work, diamonds with negative charged silicon‐vacancy (SiV−) centers have been designed for use as thermometers in biomedical applications. Multiparametric analysis of the emission characteristics of the SiV− centers provides extraordinary sensitivity for temperature detection in the physiological temperature range.
María Gragera, Iván Carrillo‐Berdugo, Josue Millán, Paulius Pobedinskas, Antonio Freire, Ken Haenen, Javier Navas   +6 more
wiley   +1 more source