Single-atom catalysis has been recognized as a pivotal milestone in the development
history of heterogeneous catalysis by virtue of its superior catalytic performance, ultrahigh …

Catalysis is essential to modern life and has a huge economic impact. The development of
new catalysts critically depends on synthetic methods that enable the preparation of tailored …

Two-dimensional transition-metal carbides and nitrides, known as MXenes, have garnered
increasing attention for nearly a decade by virtue of their versatile composition and structure …

CO oxidation is an important primary reaction in automotive catalysis, and has been studied
extensively since the 1970s because of its fundamental nature and technological relevance …

Heterogeneous catalysts are widely used to promote chemical reactions. Although it is
known that chemical reactions usually happen on catalyst surfaces, only specific surface …

Dehydrogenation reactions are key steps in many metal‐catalyzed chemical processes and
in the on‐surface synthesis of atomically precise nanomaterials. The principal role of the …

We review the state-of-the-art in the theory of dissociative chemisorption (DC) of small gas
phase molecules on metal surfaces, which is important to modeling heterogeneous catalysis …

The challenge of evaluating catalyst surface–molecular adsorbate interactions holds the key
for rational design of catalysts. Finding an experimentally measurable and theoretically …

Catalysts are widely used to increase reaction rates. They function by stabilizing the
transition state of the reaction at their active site, where the atomic arrangement ensures …

The adsorption and electrooxidation of CO molecules at well‐defined Pt (hkl) single‐crystal
electrode surfaces is a key step towards addressing catalyst poisoning mechanisms in fuel …