Results 231 to 240 of about 378,092 (297)
Computational Simulations of Metal–Organic Frameworks to Enhance Adsorption Applications
Advanced Materials, EarlyView.This review highlights the significance of molecular simulations in expanding the understanding of metal–organic frameworks (MOFs) and improving their gas adsorption applications. The historical development and implementation of molecular simulations in the MOF field are given, high‐throughput computational screening studies used to unlock the ...
Hilal Daglar +3 more
wiley +1 more source
The Gibbs Fundamental Relation as a Tool for Relativity. [PDF]
Entropy (Basel)Herrmann F, Pohlig M.
europepmc +1 more source
Advanced Materials, EarlyView.This review examines the fluid dynamic behavior within carbonaceous porous structures, linking structural characteristics to electrolyte transport and electrochemical performance. Specifically, it quantitatively assesses the effect of polyphenol derivatives‐harnessed multiscale pore structures on active surface utilization and electrochemical activity ...
Minjun Kim +3 more
wiley +1 more source
Synthetic Aspects and Characterization Needs in MOF Chemistry – from Discovery to Applications
Advanced Materials, EarlyView.Overcoming the challenges of phase discovery, synthesis optimization and scale‐up, characterization, and computational studies is essential to accelerate the large‐scale application of MOFs. Life‐cycle analyses and techno‐economic analyses need to be performed to realistically assess their potential for industrial relevance.
Bastian Achenbach +4 more
wiley +1 more source
Direction of Spontaneous Processes in Non-Equilibrium Systems with Movable/Permeable Internal Walls. [PDF]
Entropy (Basel)Hołyst R +4 more
europepmc +1 more source
Exciton Dynamics in Layered Halide Perovskite Light‐Emitting Diodes
Advanced Materials, EarlyView.This review discusses the exciton dynamics in layered halide perovskitelight‐emitting diodes (PeLEDs). It opens with a summary of the structural and photophysical aspects, followed by an exploration of controlling dimensionality and cascade exciton transfer in quasi‐2D PeLEDs.
Sung‐Doo Baek +5 more
wiley +1 more source
Computational Modeling of Reticular Materials: The Past, the Present, and the Future
Advanced Materials, EarlyView.Reticular materials are advanced materials with applications in emerging technologies. A thorough understanding of material properties at operating conditions is critical to accelerate the deployment at an industrial scale. Herein, the status of computational modeling of reticular materials is reviewed, supplemented with topical examples highlighting ...
Wim Temmerman +3 more
wiley +1 more source
Ultrafast entropy production in nonequilibrium magnets. [PDF]
PNAS NexusTietjen F, Geilhufe RM.
europepmc +1 more source