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Grajciar, Lukáš (author), Heard, Christopher J. (author), Bondarenko, Anton A. (author), Polynski, Mikhail V. (author), Meeprasert, J. (author), Pidko, E.A. (author), Nachtigall, Petr (author)
An increased synergy between experimental and theoretical investigations in heterogeneous catalysis has become apparent during the last decade. Experimental work has extended from ultra-high vacuum and low temperature towards operando conditions. These developments have motivated the computational community to move from standard descriptive...
review 2018