Toward promising candidates of quantum information processing, the rapid development of
lanthanide-based single-molecule magnets (Ln-SMMs) highlights design strategies in …

Proton-coupled electron transfer (PCET) plays an essential role in a wide range of
electrocatalytic processes. A vast array of theoretical and computational methods have been …

The quantum approximate optimization algorithm (QAOA) is a hybrid quantum-classical
variational algorithm designed to tackle combinatorial optimization problems. Despite its …

Discussing theory and transport, synthesis, processing, properties, and applications, this
second edition of a standard resource covers advances in the field of electrically conducting …

A unified theory of homogeneous and electrochemical electron‐transfer rates is developed
using statistical mechanics. The treatment is a generalization of earlier papers of this series …

The technique of stimulated Raman adiabatic passage (STIRAP), which allows efficient and
selective population transfer between quantum states without suffering loss due to …

The Born–Oppenheimer approximation underlies much of chemical simulation and provides
the framework defining the potential energy surfaces that are used for much of our pictorial …

Since the pioneering works by Landau, Zener, Stückelberg, and Majorana (LZSM), it has
been known that driving a quantum two-level system results in tunneling between its states …

Molecules comprising a large number of coupled paramagnetic centers are attracting much
interest because they may show properties which are intermediate between those of simple …

The Born-Oppenheimer adiabatic appr~ ximatiod-~ represents one of the cornerstones of
molecular physics and chemistry. It allows the calculation of dynamical processes in …