Bochum, Germany, October 29, 2025, Researchers from Research Center for Future Energy Materials and Systems at the Ruhr University Bochum, Software for Chemistry & Materials BV, and Vrije Universiteit ...
Machine learning is transforming many scientific fields, including computational materials science. For about two decades, scientists have been using it to make accurate yet inexpensive calculations ...
Accuracy and speedup achieved with the Weighted Active Space Protocol (WASP) for methane activation on titanium carbide. (Figure courtesy of Seal et al.) Catalysts play an indispensable role in modern ...
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