Vibronic exciton model for low bandgap donor–acceptor polymers M Balooch Qarai, X Chang, FC Spano The Journal of Chemical Physics 153 (24), 2020 | 27 | 2020 |
HJ-aggregates of donor–acceptor–donor oligomers and polymers X Chang, M Balooch Qarai, FC Spano The Journal of Chemical Physics 155 (3), 2021 | 24 | 2021 |
Observation of Weak Counterion Size Dependence of Thermoelectric Transport in Ion Exchange Doped Conducting Polymers Across a Wide Range of Conductivities C Chen, IE Jacobs, K Kang, Y Lin, C Jellett, B Kang, SB Lee, Y Huang, ... Advanced Energy Materials 13 (9), 2202797, 2023 | 21 | 2023 |
Understanding bipolarons in conjugated polymers using a multiparticle Holstein approach MB Qarai, R Ghosh, FC Spano The Journal of Physical Chemistry C 125 (44), 24487-24497, 2021 | 18 | 2021 |
The electronic and structural responses of B12N12 nanocage toward the adsorption of some nonpolar X2 molecules: X=(Li, Be, B, N, O, F, Cl, Br, I): A DFT approach A Bahrami, MB Qarai, NL Hadipour Computational and Theoretical Chemistry 1108, 63-69, 2017 | 17 | 2017 |
Efficient ethanol oxidation by hemoglobin-capped gold nanoclusters: The critical role of fe in the heme group as an oxophilic metal active site M Sarparast, F Molaabasi, R Ghazfar, MM Ashtiani, MB Qarai, ... Electrochemistry Communications 103, 42-47, 2019 | 10 | 2019 |
Frenkel–Holstein Hamiltonian applied to absorption spectra of quaterthiophene-based 2D hybrid organic–inorganic perovskites SM Janke, MB Qarai, V Blum, FC Spano The Journal of Chemical Physics 152 (14), 2020 | 9 | 2020 |
Intermolecular charge transfer in h-and j-aggregates of donor–acceptor–donor chromophores: The curious case of bithiophene-dpp X Chang, M Balooch Qarai, FC Spano The Journal of Physical Chemistry C 126 (44), 18784-18795, 2022 | 7 | 2022 |
Multipolaron Complexes in Conducting Polymers: The Importance of Hole–Hole Repulsion in Charge Delocalization M Balooch Qarai, R Ghosh, NJ Hestand, FC Spano The Journal of Physical Chemistry C 127 (13), 6414-6424, 2023 | 4 | 2023 |
Absorption and Photoluminescence in π-Stacks of Donor–Acceptor–Donor Chromophores: Effective Frenkel–Holstein Hamiltonian Approach X Chang, M Balooch Qarai, FC Spano Chemistry of Materials 35 (23), 10018-10029, 2023 | 1 | 2023 |
Elucidating the Mid-Infrared Spectral Signatures of Bipolarons in Doped Organic Conjugated Polymers: A Holstein-style Multiparticle Approach M Balooch Qarai Theses and Dissertations, 2024 | | 2024 |
HJ-aggregates of donor-acceptor-donor oligomers and polymers (vol 155, 034905, 2021) X Chang, MB Qarai, FC Spano JOURNAL OF CHEMICAL PHYSICS 157 (20), 2022 | | 2022 |
Frenkel-Holstein Hamiltonian Applied to Quaterthiophene-based 2D Hybrid Organic-Inorganic Perovskites S Janke, M Qarai, V Blum, F Spano Bulletin of the American Physical Society 65, 2020 | | 2020 |