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The Journal of Physical Chemistry Letters|December 21, 2022
Extending the Applicability of the Multiple-Spawning Framework for Nonadiabatic Molecular DynamicsYorick Lassmann, Daniel Hollas, Basile F E Curchod
Theoretical Chemistry Accounts|July 31, 2023
Probing the sensitivity of ab initio multiple spawning to its parametersYorick Lassmann, Basile F E Curchod
The Journal of Chemical Physics|July 9, 2021
AIMSWISS-Ab initio multiple spawning with informed stochastic selectionsYorick Lassmann, Basile F E Curchod
The Journal of Physical Chemistry. A|October 3, 2024
AtmoSpec-A Tool to Calculate Photoabsorption Cross-Sections for Atmospheric Volatile Organic CompoundsDaniel Hollas, Basile F E Curchod
The Journal of Physical Chemistry. A|August 9, 2023
Deciphering the Influence of Ground-State Distributions on the Calculation of Photolysis ObservablesAntonio Prlj, Daniel Hollas, Basile F E Curchod
The Journal of Chemical Physics|March 16, 2021
Comparing (stochastic-selection) ab initio multiple spawning with trajectory surface hopping for the photodynamics of cyclopropanone, fulvene, and dithianeLea M Ibele, Yorick Lassmann, Todd J Martínez, et al.
Faraday Discussions|September 28, 2018
On the importance of initial conditions for excited-state dynamicsJiří Suchan, Daniel Hollas, Basile F E Curchod, et al.
The Journal of Physical Chemistry. A|September 26, 2025
Benchmarking Electronic-Structure Methods for the Description of Dark Transitions in Carbonyls at and Beyond the Franck-Condon PointJasmine Bone, Javier Carmona-García, Daniel Hollas, et al.
Journal of Chemical Theory and Computation|December 16, 2024
Assessing Nonadiabatic Dynamics Methods in Long TimescalesSaikat Mukherjee, Yorick Lassmann, Rafael S Mattos, et al.
The Journal of Chemical Physics|April 9, 2024
Predicting the photodynamics of cyclobutanone triggered by a laser pulse at 200 nm and its MeV-UED signals-A trajectory surface hopping and XMS-CASPT2 perspectiveJiří Janoš, Joao Pedro Figueira Nunes, Daniel Hollas, et al.
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