Recent years have witnessed the introduction of spatiotemporal spectroscopy for the characterization of catalysts at work at previously unattainable resolution and sensitivity. They have revealed that heterogeneous catalysts are more heterogeneous than often expected. Dynamic changes in the nature of active sites, such as their distribution and accessibility, occur both between and within parti...

Summarization of electronic discussion fora is a unique challenge; techniques that work startlingly well on monolithic documents tend to fare poorly in this informal setting. Additionally, conventional techniques ignore much of the structures that have the potential to serve as valuable features in the summarization task. We present several novel examples of such features, including the catalys...

Mesoporous alumina catalysts that incorporate nickel (Ni-Alumina) with different Ni/Al molar ratios of 1:2, 1:5 and 1:10 were synthesized by a one-step sol–gel method using lauric acid as a template. The prepared Ni-Alumina catalysts showed a relatively high surface area with a narrow pore size distribution after calcination at 700 ◦C; these effects were independent of the Ni/Al molar ratio. Al...

The overall objective of this grant is to develop a rational framework for the discovery of low cost, robust, and active nano-catalysts that will enable efficient hydrogen production. Our approach will be the first demonstration of integrated multiscale model, nano-catalyst synthesis, and nanoscale characterization assisted high throughput experimentation (HTE). We will initially demonstrate ou...

We combine classical empirical potentials and density functional theory (DFT) calculations to characterize the catalyst/electrode interface of a promising device for artificial photosynthesis. This system consists of inorganic Ru-polyoxometalate (Ru-POM) molecules that are supported by a graphitic substrate functionalized with organic dendrimers. The experimental atomic-scale characterization o...

In this study, a new recoverable catalyst for the epoxidation of olefins was developed using a layered polysiloxane as a support for immobilizing  (salen) molybdenum(VI) complex by electrostatic interaction between the surface of the solid support and the electrically charged molybdenum complex. Characterization of the heterogeneous catalyst by Fourier transform infrared, XRD,1H NMR,...

primary mgcl2.3.3etoh adduct (pct1) was prepared by melt quenching method and then submitted into a programmed thermal dealcoholation project using a fluidized bed reactor. during thermal dealcoholation program, different mgcl2.netoh support samples with n= 3.0, 2.7, 2.4, and 2.1 were selected and named as pct2 to pct5, respectively. structural analysis of the support samples showed a significa...