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Timothy J. H. Hele
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Efficient radical-based light-emitting diodes with doublet emission
X Ai, EW Evans, S Dong, AJ Gillett, H Guo, Y Chen, TJH Hele, RH Friend, ...
Nature 563 (7732), 536-540, 2018
4872018
Tuning singlet fission in π-bridge-π chromophores
E Kumarasamy, SN Sanders, MJY Tayebjee, A Asadpoordarvish, ...
Journal of the American Chemical Society 139 (36), 12488-12494, 2017
1702017
Understanding the luminescent nature of organic radicals for efficient doublet emitters and pure-red light-emitting diodes
A Abdurahman, TJH Hele, Q Gu, J Zhang, Q Peng, M Zhang, RH Friend, ...
Nature materials 19 (11), 1224-1229, 2020
1562020
Derivation of a true (t→ 0+) quantum transition-state theory. I. Uniqueness and equivalence to ring-polymer molecular dynamics transition-state-theory
TJH Hele, SC Althorpe
The Journal of chemical physics 138 (8), 2013
1362013
Communication: Relation of centroid molecular dynamics and ring-polymer molecular dynamics to exact quantum dynamics
TJH Hele, MJ Willatt, A Muolo, SC Althorpe
The Journal of Chemical Physics 142 (19), 2015
1292015
Boltzmann-conserving classical dynamics in quantum time-correlation functions:“Matsubara dynamics”
TJH Hele, MJ Willatt, A Muolo, SC Althorpe
The Journal of Chemical Physics 142 (13), 2015
1262015
Switching between coherent and incoherent singlet fission via solvent-induced symmetry breaking
AM Alvertis, S Lukman, TJH Hele, EG Fuemmeler, J Feng, J Wu, ...
Journal of the American Chemical Society 141 (44), 17558-17570, 2019
892019
Vibrationally assisted intersystem crossing in benchmark thermally activated delayed fluorescence molecules
EW Evans, Y Olivier, Y Puttisong, WK Myers, TJH Hele, SM Menke, ...
The Journal of Physical Chemistry Letters 9 (14), 4053-4058, 2018
792018
Derivation of a true (t→ 0+) quantum transition-state theory. II. Recovery of the exact quantum rate in the absence of recrossing
SC Althorpe, TJH Hele
The Journal of chemical physics 139 (8), 2013
702013
Efficient light-emitting diodes from organic radicals with doublet emission
JM Hudson, TJH Hele, EW Evans
Journal of Applied Physics 129 (18), 2021
482021
Deriving the exact nonadiabatic quantum propagator in the mapping variable representation
TJH Hele, N Ananth
Faraday Discussions 195, 269-289, 2016
452016
Nonadiabatic semiclassical dynamics in the mixed quantum-classical initial value representation
MS Church, TJH Hele, GS Ezra, N Ananth
The Journal of chemical physics 148 (10), 2018
412018
Environmental Control of Triplet Emission in Donor–Bridge–Acceptor Organometallics
J Feng, L Yang, AS Romanov, J Ratanapreechachai, APM Reponen, ...
Advanced Functional Materials, 1908715, 2020
392020
On the uniqueness of t → 0+ quantum transition-state theory
TJH Hele, SC Althorpe
The Journal of chemical physics 139, 084116, 2013
382013
A mapping variable ring polymer molecular dynamics study of condensed phase proton-coupled electron transfer
S Pierre, JR Duke, TJH Hele, N Ananth
The Journal of Chemical Physics 147 (23), 2017
362017
Competing quantum effects in the free energy profiles and diffusion rates of hydrogen and deuterium molecules through clathrate hydrates
JR Cendagorta, A Powers, TJH Hele, O Marsalek, Z Bačić, ME Tuckerman
Physical Chemistry Chemical Physics 18 (47), 32169-32177, 2016
362016
Singlet and triplet to doublet energy transfer: improving organic light-emitting diodes with radicals
F Li, AJ Gillett, Q Gu, J Ding, Z Chen, TJH Hele, WK Myers, RH Friend, ...
Nature Communications 13 (1), 2744, 2022
332022
On the relation between thermostatted ring-polymer molecular dynamics and exact quantum dynamics
TJH Hele
Molecular Physics 114 (9), 1461-1471, 2016
322016
Thermal quantum time-correlation functions from classical-like dynamics
TJH Hele
Molecular Physics 13, 1435-1462, 2017
272017
Anticipating acene-based chromophore spectra with molecular orbital arguments
TJH Hele, EG Fuemmeler, SN Sanders, E Kumarasamy, MY Sfeir, ...
The Journal of Physical Chemistry A 123 (13), 2527-2536, 2019
262019
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