Coherence in Chemistry: Foundations and Frontiers

JD Schultz, JL Yuly, EA Arsenault, K Parker… - Chemical …, 2024 - ACS Publications
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 …

Nonlinear molecular electronic spectroscopy via mctdh quantum dynamics: From exact to approximate expressions

F Segatta, DA Ruiz, F Aleotti, M Yaghoubi… - Journal of chemical …, 2023 - ACS Publications
We present an accurate and efficient approach to computing the linear and nonlinear optical
spectroscopy of a closed quantum system subject to impulsive interactions with an incident …

[HTML][HTML] QDT—A Matlab toolbox for the simulation of coupled quantum systems and coherent multidimensional spectroscopy

T Kenneweg, S Mueller, T Brixner, W Pfeiffer - Computer Physics …, 2024 - Elsevier
We present QDT (“quantum dynamics toolbox”), an open-source Matlab software package
that enables users to simulate coupled quantum systems in the subsystem energy …

Vibrational response functions for multidimensional electronic spectroscopy: From Duschinsky rotations to multimode squeezed coherent states

FE Quintela Rodriguez, F Troiani - The Journal of Chemical Physics, 2023 - pubs.aip.org
Multidimensional spectroscopy unveils the interplay of nuclear and electronic dynamics,
which characterizes the ultrafast dynamics of various molecular and solid-state systems. In a …