Barry D Dunietz
10PUBLICATIONS
142CO-AUTHORS
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Publications (10)
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|Sep 02, 2021
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package.Evgeny Epifanovsky, Andrew T B Gilbert, Xintian Feng
|Jul 09, 2021
Simulating energy transfer dynamics in the Fenna-Matthews-Olson complex via the modified generalized quantum master equation.Ellen Mulvihill, Kristina M Lenn, Xing Gao
|Jul 09, 2021
Three-state harmonic models for photoinduced charge transfer.Dominikus Brian, Zengkui Liu, Barry D Dunietz
|Jul 09, 2021
CTRAMER: An open-source software package for correlating interfacial charge transfer rate constants with donor/acceptor geometries in organic photovoltaic materials.Jacob Tinnin, Huseyin Aksu, Zhengqing Tong
|Oct 09, 2020
Photoinduced charge transfer in Zn(II) and Au(III)-ligated symmetric and asymmetric bacteriochlorin dyads: A computational study.Huseyin Aksu, Buddhadev Maiti, Marcin Ptaszek
|Oct 02, 2020
Erratum: "Charge transfer rate constants for the carotenoid-porphyrin-C60 molecular triad dissolved in tetrahydrofuran: The spin-boson model vs the linearized semiclassical approximation" [J. Chem. Phys. 153, 044105 (2020)].Zhengqing Tong, Xing Gao, Margaret S Cheung
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Frequent Collaborators
8 joint publications
Eitan Geva
6 joint publications
Xiang Sun
4 joint publications
Alexander Schubert
4 joint publications
Xing Gao
3 joint publications
Zhengqing Tong
3 joint publications
Margaret S Cheung
2 joint publications
Ellen Mulvihill
1 joint publications
Alexei A Kananenka
1 joint publications
Yudan Liu
1 joint publications
Marcin Ptaszek
