Yusuf Hamied Department of Chemistry

Dr Aaron Kelly

Assistant Research Professor

Publications

Emerging opportunities and future directions: general discussion
SC Althorpe, W Barford, J Blumberger, C Bungey, I Burghardt, A Datta, S Ghosh, S Giannini, T Grünbaum, S Habershon, S Hammes-Schiffer, S Hay, S Iyengar, G Jones, A Kelly, K Komarova, J Lawrence, Y Litman, J Mannouch, D Manolopoulos, C Martens, RJ Maurer, M Melander, M Rossi, K Sakaushi, M Saller, A Schile, S Sturniolo, G Trenins, G Worth
Faraday Discuss
(2020)
221
(doi: 10.1039/c9fd90077b)
Improved population operators for multi-state nonadiabatic dynamics with the mixed quantum-classical mapping approach
MAC Saller, A Kelly, JO Richardson
Faraday Discuss
(2020)
221
(doi: 10.1039/c9fd00050j)
Exciton dissociation and charge separation at donor–acceptor interfaces from quantum-classical dynamics simulations
A Kelly
Faraday Discussions
(2020)
221
(doi: 10.1039/c9fd00069k)
Zero-point energy and tunnelling: general discussion.
SC Althorpe, AM Alvertis, W Barford, RL Benson, I Burghardt, S Giannini, S Habershon, S Hammes-Schiffer, S Hay, S Iyengar, A Kelly, K Komarova, J Lawrence, Y Litman, C Martens, RJ Maurer, D Plant, M Rossi, K Sakaushi, A Schile, S Sturniolo, DP Tew, G Trenins, G Worth
Faraday Discussions
(2020)
221
(doi: 10.1039/c9fd90075f)
Benchmarking semiclassical and perturbative methods for real-time simulations of cavity-bound emission and interference
NM Hoffmann, C Schäfer, N Säkkinen, A Rubio, H Appel, A Kelly
The Journal of Chemical Physics
(2019)
151
(doi: 10.1063/1.5128076)
Efficient construction of generalized master equation memory kernels for multi-state systems from nonadiabatic quantum-classical dynamics
WC Pfalzgraff, A Montoya-Castillo, A Kelly, TE Markland
The Journal of Chemical Physics
(2019)
150
(doi: 10.1063/1.5095715)
Capturing vacuum fluctuations and photon correlations in cavity quantum electrodynamics with multitrajectory Ehrenfest dynamics
NM Hoffmann, C Schäfer, A Rubio, A Kelly, H Appel
Physical Review A
(2019)
99
(doi: 10.1103/PhysRevA.99.063819)
Mean field theory of thermal energy transport in molecular junctions.
A Kelly
J Chem Phys
(2019)
150
(doi: 10.1063/1.5089885)
Mixed quantum classical dynamics and surfaces for photons
N Hoffmann, C Schafer, A Kelly, H Appel, N Maitra, A Rubio
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2019)
257
Nonadiabatic quantum dynamics without potential energy surfaces
G Albareda, A Kelly, A Rubio
Physical Review Materials
(2019)
3
(doi: 10.1103/physrevmaterials.3.023803)

Research Interest Group

Email address

ak2812@cam.ac.uk
Yusuf Hamied Department of Chemistry
Lensfield Road
Cambridge
CB2 1EW
T: +44 (0) 1223 336300
enquiries@ch.cam.ac.uk
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