The quantum nature of electrons and nuclei is manifested in countless biological events
including the rearrangements of electrons in biochemical reactions, electron and proton …

Coherence refers to correlations in waves. Because matter has a wave-particle nature, it is
unsurprising that coherence has deep connections with the most contemporary issues in …

A simple surface hopping method for nonadiabatic molecular dynamics is developed. The
method derives from a stochastic modeling of the time-dependent Schrödinger and master …

Excitation energy transfer (EET) is fundamental to many processes in chemical and
biological systems and carries significant implications for the design of materials suitable for …

A complete treatment of the entanglement of two-level systems, which evolves through the
contact with a thermal bath, must include the fact that the system and the bath are not fully …

Abstract The Multiconfigurational Ehrenfest (MCE) method is a quantum dynamics technique
which allows treatment of a large number of quantum nuclear degrees of freedom. This …

This paper reports the release of PATHSUM, a new software suite of state-of-the-art path
integral methods for studying the dynamics of single or extended systems coupled to …

Understanding how the complex interplay among excitonic interactions, vibronic couplings,
and reorganization energy determines coherence-enabled transport mechanisms is a grand …

The recurrent neural network with the long short-term memory cell (LSTM-NN) is employed
to simulate the long-time dynamics of open quantum systems. The bootstrap method is …

▪ Abstract Quantum dissipation involves both energy relaxation and decoherence, leading
toward quantum thermal equilibrium. There are several theoretical prescriptions of quantum …