Results 221 to 230 of about 602,983 (281)

A Mechanistic Blueprint for Fast, High‐Yield Green Scintillators Using Conjugated Polymer–Nanocrystal Composites

Advanced Functional Materials, EarlyView.
Conjugated polymer–nanocrystal composites are investigated to develop fast, high‐yield green scintillators. The polymer F8BT enables efficient, ultrafast emission, while blends with non‐emitting HfO2 nanocrystals and luminescent CdZnS/ZnS quantum dots reveal distinct sensitization mechanisms.
Chenger Wang, Emanuele Mazzola, Andrea Fratelli, Matteo L. Zaffalon, Francesco Bruni, Francesco Carulli, Xiaohe Zhou, Saptarshi Chakraborty, Leonardo Poletti, Luca Cappelletti, Francesco Meinardi, Francesca Rossi, Luca Gironi, Sergio Brovelli   +13 more
wiley   +1 more source

Mechanisms of Okanin against wound healing based on network pharmacology, molecular docking and molecular dynamics simulation. [PDF]

Sci Rep
Zhao C, Li Y, Lin J, Chen Y, Zeng J, Wang Z, You Z, Chen Y, Zhang W, Huang J, Xie Y, Wu X, Shi R, Wang J.   +13 more
europepmc   +1 more source

Engineering Hydrogen‐Down Water Configurations for Ampere‐Level Electrochemical CO2 Reduction to Formate

Advanced Functional Materials, EarlyView.
Electrochemical CO2 reduction (ECR) to formate is a promising route for sustainable chemical production. Herein, we report the synthesis catalysed byBi‐HfO2@C. The AIMD simulations, DFT calculations, and in situ SEIRAS measurements show that the modification of HfO2 on the Bi surface steers the interfacial water to adopt a favorable hydrogen‐down (OH2↓)
Xiao‐Dong Guo, Shao‐Qing Liu, Jia‐Yi Wu, Qi‐Rui Wen, Xiaoxiao Wei, Shu‐Wen Wu, Xian‐Zhu Fu, Jing‐Li Luo   +7 more
wiley   +1 more source

Tribological behavior of high-entropy alloy FeNiCrMn: a molecular dynamics simulation study. [PDF]

RSC Adv
Yang N, Liu H, Xu F, He Q, Liu X, Mi N.
europepmc   +1 more source

Effect of temperature on the wetting performance of coal powder by different surfactant solutions: experimental and molecular dynamics simulation study. [PDF]

Sci Rep
Fu W, Kang J, Liang W, Deng P.
europepmc   +1 more source

Dimeric Polyphenol Effect on Liquid-Ordered and Liquid-Disordered Membranes: Combined Insights from Molecular Dynamics Simulation and Langmuir Balance Measurements. [PDF]

Langmuir
Wang R, Heinonen S, Vuorimaa-Laukkanen E, Li C, Viitala T, Bunker A.   +5 more
europepmc   +1 more source

Sweetness enhancement and mechanism by sweet aroma compounds in the sucrose solution using sensory, electronic tongue, molecular docking, and molecular dynamics simulation. [PDF]

Food Chem X
Liu J, Niu Y, Zhu J, Zhou R, Guo Z, Miao Z, Lu Q, Yu Y, Zhang J, Xiao Z, Xiao Q.   +10 more
europepmc   +1 more source