Synthesis of Heterogeneous Catalysts in Catalyst Informatics to Bridge Experiment and High-Throughput Calculation.
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DOI: 10.1021/jacs.2c06143
Abstract: The coupling of high-throughput calculations with catalyst informatics is proposed as an alternative way to design heterogeneous catalysts. High-throughput first-principles calculations for the oxidative coupling of methane (OCM) reaction are designed and performed where 1972… read more here.
Keywords: heterogeneous catalysts; throughput calculations; high throughput; synthesis heterogeneous ... See more keywords