Yifei Chen

TL;DR: Electronic analysis proves that the role of In is to donate electrons, which can increase the electron density of Ni and enhance the catalytic activity, which shows great advantages for the following CH3CHO* formation.

TL;DR: In this paper , high-throughput calculations were used to efficiently screen the metal-organic frameworks (MOFs) with excellent CF4-selective adsorption performance based on the 796 MOFs from the CoRE MOF database and 10 top-performing materials were identified, in which JUCXEK stands out with the highest CF4 selectivity of 50.15.

TL;DR: In this article , the ReaxFF MD simulation was adopted to investigate the pyrolytic behavior of acetylene at various temperatures and pressures, and the simulation results revealed that the mechanism of the acetylene could be divided into three temperature ranges: (i) T < 1200 K, where homogenous molecular polymerization of polyacetylene occurs, producing polymerization products primarily C4H4 and C6H6; (ii) 1200 > T <1800 K where the free radical path competes with the molecular path, and free radicals such as C2H3⋅ and C 4H3 participate in the polymerization reaction.

TL;DR: In this paper , the effect of coordination modes on the selectivity and activity of allyl alcohol hydroformylation catalysts using Rhodium complexes was investigated, and it was shown that the AA insertion step of AA increased selectivity, and the asymmetric structure of Rh-PPh3 complexes led to a higher l/b ratio (linear/branched ratios).

TL;DR: In this article , the authors used the x-ray imaging crystal spectrometer (XCS) in Experimental Advanced Superconducting Tokamak (EAST) under various combined auxiliary heating plasmas conditions.