Results 251 to 260 of about 515,767 (328)
Valence Bond Insights into the H-Abstraction Barrier in Cytochrome P450. [PDF]
Zhang E, Hirao H.
europepmc +1 more source
Asymmetric nanofiber membranes are constructed for simultaneous moisture adsorption and catalytic hydrolysis of dimethyl 4‐nitrophenyl phosphate (DMNP) in a wide range of relative humidity. The membrane exhibits high moisture adsorption capacity and fast hygroscopic rate.
Xuejiao Wang+6 more
wiley +1 more source
Accurate and efficient machine learning interatomic potentials for finite temperature modelling of molecular crystals. [PDF]
Della Pia F+5 more
europepmc +1 more source
Fluoride‐Free Molten Salt Hydrate‐Assisted Synthesis of MXene in Air Down to 150 °C
A novel low‐temperature shielded salt (LSS) approach enables the synthesis of MXenes in air at temperatures as low as 150 °C using MgCl2·6H2O/LiCl. This method demonstrates successful etching of challenging MXenes like Cr2CTx and Nb2CTx through the synergistic effects of Li+ ions and salt hydrate phase changes, while eliminating the need for inert ...
Sin‐Yi Pang+7 more
wiley +1 more source
First-principles theory for cerium predicts three distinct face-centered cubic phases. [PDF]
Söderlind P+4 more
europepmc +1 more source
A series of ACHPES‐based hydrogels are developed and realizing multiple functions like anti‐fouling properties, alkali‐induced color/fluorescence‐changing ability and strain sensing. Furthermore, the hydrogels show excellent anti‐freezing performance, whose optical, mechanical and electrical properties remain stable at −47.3 °C.
Gaopeng Wang+9 more
wiley +1 more source
First-principles Hubbard parameters with automated and reproducible workflows. [PDF]
Bastonero L+6 more
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The replacement of the anodic OER in CO2RR with energy‐saving methanol oxidation reaction and the creation of a favorable microenvironment through interfacial Cl− ions enable concurrent formate production at industrial‐level current densities. Abstract The efficient electrocatalytic conversion of CO2 to formate is often impeded by the high energy ...
Yiqun Chen+7 more
wiley +1 more source
Symmetry-constrained generation of diverse low-bandgap molecules with Monte Carlo tree search. [PDF]
Subramanian A+5 more
europepmc +1 more source
Flexible Optical Fiber Stress/Temperature Dual‐Mode Sensing Based on CaZnOS:Nd,Er
Temperature and stress sensing based on flexible optical fibers may be the key to future artificial intelligence's perception of the world, here an optical fiber sensor capable of realizing such dual mode sensing is preliminary confirmed based on CaZnOS:Nd3+,Er3+.
Pan Zheng+12 more
wiley +1 more source