WebTran T, Jenkins AJ, Worth GA, Robb MA. The quantum-Ehrenfest method with the inclusion of an IR pulse: Application to electron dynamics of the allene radical cation. The Journal of Chemical Physics. 153: 031102. PMID 32716173 DOI: 10.1063/5.0015937 : 0.64: 2024: Geng T, Ehrmaier J, Schalk O, Richings GW, Hansson T, Worth GA, Thomas RD. WebGraham Worth is Professor of Physical Chemistry. He moved to UCL in 2016. Before this, he worked at the University of Birmingham from 2005 -2016 (research fellow, senior lecturer, professor) and at King's College London 2000 – 2005 (research fellow, lecturer). Prior to that he was a Marie-Curie Fellow then a Research Assistant at the ...
Graham Worth - Banff International Research Station
WebGraham A. Worth's 153 research works with 8,502 citations and 5,284 reads, ... In this work we set up a model Hamiltonian to study the excited state quantum dynamics of 1,1 … WebGraham Worth is Professor of Physical Chemistry. He moved to UCL in 2016. Before this, he worked at the University of Birmingham from 2005 -2016 (research fellow, senior lecturer, … they\u0027ve qt
Worth, Graham [WorldCat Identities]
WebPart 2 Extension to New Areas. 13 Direct Dynamics With Quantum Nuclei (Benjamin Lasorne and Graham A. Worth). 13.1 Introduction. 13.2 Variational Multiconfiguration Gaussian … WebAug 11, 2024 · We integrate a quantum dynamics propagation scheme, based on a linear vibronic model parameterized through time dependent density functional theory calculations, with four different solvation models, either implicit or explicit. On average, after 50 fs, 30∼40 % of the bright excited state population has been transferred to GC-CT. WebAug 25, 2024 · This Special Topic issue on Quantum Dynamics with Ab Initio Potentials contains 53 contributions from the theoretical chemical physics community on new methods and applications of quantum mechanical characterization of dynamical processes using ab initio potential energy surfaces. These publications provide a snapshot of this … saft oder smoothie