This paper studied the mechanism of the alkene insertion elementary step in the asymmetric hydroformylation （AHF） catalyzed by RhH（CO）2[（R,S）-Yanphos] using four alkene substrates （CH2=CH- Ph, CH2=CH-Ph-（p）-M...This paper studied the mechanism of the alkene insertion elementary step in the asymmetric hydroformylation （AHF） catalyzed by RhH（CO）2[（R,S）-Yanphos] using four alkene substrates （CH2=CH- Ph, CH2=CH-Ph-（p）-Me, CH2=CH-C（==O）OCH3 and CH2=CH-OC（=O）-Ph, abbreviated as A1-A4）. Interestingly, the equatorial vertical coordination mode （A mode） with respect to the Rh center was found for AI and A2 but not for A3 and A4, although the equatorial in-plane coordination mode （E mode） was found for A1 -A4. The relative energy of the E mode of the -q2-intermediates is lower than that of the A mode. In the alkene insertion step, Path 1 is more favorable than Path 2 for this system. As for AI and A2, there could be a transformation between 2eq and 2ax.展开更多
Composite-metal joints with a metal insert are one kind of connecting structure.In this paper,tensile experimental tests were carried out to investigate tensile properties of a compositemetal joint with a novel metal ...Composite-metal joints with a metal insert are one kind of connecting structure.In this paper,tensile experimental tests were carried out to investigate tensile properties of a compositemetal joint with a novel metal insert design.Finite element models of the joint were established,and strain distribution and tensile strength were analyzed.The numerical results are in good agreement with the experimental results.Results show that the joint failure is dominated by shear properties of the resin layer.Increasing the resin layer thickness in a certain range will improve the tensile strength of the joint,while increasing the radius of the fillet on the ending side of the metal insert will decrease the joint strength.Increasing the resin layer plasticity will improve the joint strength.The effect of the embedded depth of the metal insert can be ignored.展开更多
基金in part supported by the National Natural Science Foundation of China (Nos. 21072018 and 21203006)
文摘This paper studied the mechanism of the alkene insertion elementary step in the asymmetric hydroformylation （AHF） catalyzed by RhH（CO）2[（R,S）-Yanphos] using four alkene substrates （CH2=CH- Ph, CH2=CH-Ph-（p）-Me, CH2=CH-C（==O）OCH3 and CH2=CH-OC（=O）-Ph, abbreviated as A1-A4）. Interestingly, the equatorial vertical coordination mode （A mode） with respect to the Rh center was found for AI and A2 but not for A3 and A4, although the equatorial in-plane coordination mode （E mode） was found for A1 -A4. The relative energy of the E mode of the -q2-intermediates is lower than that of the A mode. In the alkene insertion step, Path 1 is more favorable than Path 2 for this system. As for AI and A2, there could be a transformation between 2eq and 2ax.
基金the National Natural Science Foundation of China(No.11472024)for financial support
文摘Composite-metal joints with a metal insert are one kind of connecting structure.In this paper,tensile experimental tests were carried out to investigate tensile properties of a compositemetal joint with a novel metal insert design.Finite element models of the joint were established,and strain distribution and tensile strength were analyzed.The numerical results are in good agreement with the experimental results.Results show that the joint failure is dominated by shear properties of the resin layer.Increasing the resin layer thickness in a certain range will improve the tensile strength of the joint,while increasing the radius of the fillet on the ending side of the metal insert will decrease the joint strength.Increasing the resin layer plasticity will improve the joint strength.The effect of the embedded depth of the metal insert can be ignored.
