Graham A Worth

发表

Applying Direct Molecular Dynamics to Non‐Adiabatic Systems

G. A. Worth, M. Robb, M. A. Robb, 2003 .

Coherent Mixing of Singlet and Triplet States in Acrolein and Ketene: A Computational Strategy for Simulating the Electron–Nuclear Dynamics of Intersystem Crossing

M. Robb, M. Bearpark, Andrew J. Jenkins, 2023, Journal of Physical Chemistry Letters.

Direct quantum dynamics using variational multi-configuration Gaussian wavepackets. Implementation details and test case.

G. Worth, M. Robb, B. Lasorne, 2007, Physical chemistry chemical physics : PCCP.

Two-dimensional vibronic spectroscopy of molecular aggregates: Trimers, dimers, and monomers.

G. Worth, V. Engel, M. Kess, 2016, The Journal of chemical physics.

A novel algorithm for non-adiabatic direct dynamics using variational Gaussian wavepackets.

G. Worth, M. Robb, I. Burghardt, 2004, Faraday discussions.

Quantum dynamics simulations using Gaussian wavepackets: the vMCG method

Gareth W Richings, G. Worth, I. Burghardt, 2015 .

Multimode quantum dynamics using Gaussian wavepackets: The Gaussian-based multiconfiguration time-dependent Hartree (G-MCTDH) method applied to the absorption spectrum of pyrazine.

G. Worth, I. Burghardt, G A Worth, 2008, The Journal of chemical physics.

Using the MCTDH wavepacket propagation method to describe multimode non-adiabatic dynamics

Lorenz S. Cederbaum, Irene Burghardt, Graham A. Worth, 2008 .

Quantics: A general purpose package for Quantum molecular dynamics simulations

G. A. Worth, G. Worth, Graham A Worth, 2020, Comput. Phys. Commun..