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Journal of Chemical Theory and Computation|August 23, 2022
Infrared Spectra at Coupled Cluster Accuracy from Neural Network RepresentationsRichard Beckmann, Fabien Brieuc, Christoph Schran, et al.Physical Chemistry Chemical Physics : PCCP|August 22, 2024
Theoretical infrared spectroscopy of protonated methane isotopologuesRichard Beckmann, Christoph Schran, Fabien Brieuc, et al.Journal of Chemical Theory and Computation|September 16, 2018
Converged Colored Noise Path Integral Molecular Dynamics Study of the Zundel Cation Down to Ultralow Temperatures at Coupled Cluster AccuracyChristoph Schran, Fabien Brieuc, Dominik MarxThe Journal of Chemical Physics|February 9, 2021
Transferability of machine learning potentials: Protonated water neural network potential applied to the protonated water hexamerChristoph Schran, Fabien Brieuc, Dominik MarxJournal of Chemical Theory and Computation|September 22, 2020
Deciphering High-Order Structural Correlations within Fluxional Molecules from Classical and Quantum Configurational EntropyRafał Topolnicki, Fabien Brieuc, Christoph Schran, et al.The Journal of Chemical Physics|August 20, 2022
Neural network interaction potentials for para-hydrogen with flexible moleculesLaura DuránCaballero, Christoph Schran, Fabien Brieuc, et al.Chemical Science|November 2, 2022
State-resolved infrared spectrum of the protonated water dimer: revisiting the characteristic proton transfer doublet peakHenrik R Larsson, Markus Schröder, Richard Beckmann, et al.The Journal of Chemical Physics|June 8, 2020
Converged quantum simulations of reactive solutes in superfluid helium: The Bochum perspectiveFabien Brieuc, Christoph Schran, Felix Uhl, et al.Physical Review Letters|March 10, 2023
Onset of Rotational Decoupling for a Molecular Ion Solvated in Helium: From Tags to Rings and ShellsJulia A Davies, Christoph Schran, Fabien Brieuc, et al.Physical Chemistry Chemical Physics : PCCP|November 9, 2019
Quantum nature of the hydrogen bond from ambient conditions down to ultra-low temperaturesChristoph Schran, Dominik MarxPageof 26