Publications of Romain Berraud-Pache
All genres
Journal Article (6)
2021
Journal Article
12 (8), pp. 2916 - 2924 (2021)
Redesigning donor–acceptor Stenhouse adduct photoswitches through a joint experimental and computational study. Chemical Science 2020
Journal Article
124 (40), pp. 8761 - 8771 (2020)
Accurate Computation of the Absorption Spectrum of Chlorophyll a with Pair Natural Orbital Coupled Cluster Methods. The Journal of Physical Chemistry B
Journal Article
118 (19-20), e1818858 (2020)
A new density for transition properties within the similarity transformed equation of motion approach. Molecular Physics
Journal Article
118 (19-20), e1776903 (2020)
Potential energy surfaces of charge transfer states. Molecular Physics
Journal Article
16 (1), pp. 564 - 575 (2020)
Unveiling the Photophysical Properties of Boron-dipyrromethene Dyes Using a New Accurate Excited State Coupled Cluster Method. Journal of Chemical Theory and Computation 2019
Journal Article
10 (17), pp. 4822 - 4828 (2019)
Computational Design of Near-Infrared Fluorescent Organic Dyes Using an Accurate New Wave Function Approach. The Journal of Physical Chemistry Letters