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Designing Conjugated Polymers for Photocatalysis and Ion Transport

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Tunable Control of the Hydrophilicity and Wettability of Conjugated Polymers by a Postpolymerization Modification Approach

Author(s): Shengyu Cong, Adam Creamer, Zhuping Fei, Sam A. J. Hillman, Charlotte Rapley, Jenny Nelson, Martin Heeney
Published in: Macromolecular Bioscience, Issue 20/11, 2020, Page(s) 2000087, ISSN 1616-5187
DOI: 10.1002/mabi.202000087

Assessing the feasibility of carbon dioxide mitigation options in terms of energy usage

Author(s): Oytun Babacan, Sven De Causmaecker, Ajay Gambhir, Mathilde Fajardy, A. William Rutherford, Andrea Fantuzzi, Jenny Nelson
Published in: Nature Energy, Issue 5/9, 2020, Page(s) 720-728, ISSN 2058-7546
DOI: 10.1038/s41560-020-0646-1

Correlating the Phase Behavior with the Device Performance in Binary Poly-3-hexylthiophene: Nonfullerene Acceptor Blend Using Optical Probes of the Microstructure

Author(s): Elham Rezasoltani, Anne A. Y. Guilbert, Jun Yan, Xabier Rodríguez-Martínez, Mohammed Azzouzi, Flurin Eisner, Sachetan M. Tuladhar, Zeinab Hamid, Andrew Wadsworth, Iain McCulloch, Mariano Campoy-Quiles, Jenny Nelson
Published in: Chemistry of Materials, Issue 32/19, 2020, Page(s) 8294-8305, ISSN 0897-4756
DOI: 10.1021/acs.chemmater.0c02093

Ring fusion in tetrathienylethene cored perylene diimide tetramers affords acceptors with strong and broad absorption in the near-UV to visible region

Author(s): Qiao He, Flurin D. Eisner, Drew Pearce, Thomas Hodsden, Elham Rezasoltani, Daniel Medranda, Zhuping Fei, Jenny Nelson, Martin Heeney
Published in: Journal of Materials Chemistry C, 2020, ISSN 2050-7534
DOI: 10.1039/d0tc04110f

The influence of nitrogen position on charge carrier mobility in enantiopure aza[6]helicene crystals

Author(s): Francesco Salerno, Beth Rice, Julia A. Schmidt, Matthew J. Fuchter, Jenny Nelson, Kim E. Jelfs
Published in: Physical Chemistry Chemical Physics, Issue 21/9, 2019, Page(s) 5059-5067, ISSN 1463-9076
DOI: 10.1039/c8cp07603k

Hybridization of Local Exciton and Charge-Transfer States Reduces Nonradiative Voltage Losses in Organic Solar Cells

Author(s): Flurin D. Eisner, Mohammed Azzouzi, Zhuping Fei, Xueyan Hou, Thomas D. Anthopoulos, T. John S. Dennis, Martin Heeney, Jenny Nelson
Published in: Journal of the American Chemical Society, Issue 141/15, 2019, Page(s) 6362-6374, ISSN 0002-7863
DOI: 10.1021/jacs.9b01465

Polaron States in Fullerene Adducts Modeled by Coarse-Grained Molecular Dynamics and Tight Binding

Author(s): Beth Rice, Anne A. Y. Guilbert, Jarvist M. Frost, Jenny Nelson
Published in: The Journal of Physical Chemistry Letters, Issue 9/22, 2018, Page(s) 6616-6623, ISSN 1948-7185
DOI: 10.1021/acs.jpclett.8b02320

Nonradiative Energy Losses in Bulk-Heterojunction Organic Photovoltaics

Author(s): Mohammed Azzouzi, Jun Yan, Thomas Kirchartz, Kaikai Liu, Jinliang Wang, Hongbin Wu, Jenny Nelson
Published in: Physical Review X, Issue 8/3, 2018, ISSN 2160-3308
DOI: 10.1103/physrevx.8.031055

Understanding structure-activity relationships in linear polymer photocatalysts for hydrogen evolution

Author(s): Michael Sachs, Reiner Sebastian Sprick, Drew Pearce, Sam A. J. Hillman, Adriano Monti, Anne A. Y. Guilbert, Nick J. Brownbill, Stoichko Dimitrov, Xingyuan Shi, Frédéric Blanc, Martijn A. Zwijnenburg, Jenny Nelson, James R. Durrant, Andrew I. Cooper
Published in: Nature Communications, Issue 9/1, 2018, ISSN 2041-1723
DOI: 10.1038/s41467-018-07420-6

Design and evaluation of conjugated polymers with polar side chains as electrode materials for electrochemical energy storage in aqueous electrolytes

Author(s): Davide Moia, Alexander Giovannitti, Anna A. Szumska, Iuliana P. Maria, Elham Rezasoltani, Michael Sachs, Martin Schnurr, Piers R. F. Barnes, Iain McCulloch, Jenny Nelson
Published in: Energy & Environmental Science, Issue 12/4, 2019, Page(s) 1349-1357, ISSN 1754-5692
DOI: 10.1039/c8ee03518k

Spectroscopic Investigation of the Effect of Microstructure and Energetic Offset on the Nature of Interfacial Charge Transfer States in Polymer: Fullerene Blends

Author(s): S. D. Dimitrov, M. Azzouzi, J. Wu, J. Yao, Y. Dong, P. Shakya Tuladhar, B. C. Schroeder, E. R. Bittner, I. McCulloch, J. Nelson, J. R. Durrant
Published in: Journal of the American Chemical Society, Issue 141/11, 2019, Page(s) 4634-4643, ISSN 0002-7863
DOI: 10.1021/jacs.8b11484

The 2019 materials by design roadmap

Author(s): Kirstin Alberi, Marco Buongiorno Nardelli, Andriy Zakutayev, Lubos Mitas, Stefano Curtarolo, Anubhav Jain, Marco Fornari, Nicola Marzari, Ichiro Takeuchi, Martin L Green, Mercouri Kanatzidis, Mike F Toney, Sergiy Butenko, Bryce Meredig, Stephan Lany, Ursula Kattner, Albert Davydov, Eric S Toberer, Vladan Stevanovic, Aron Walsh, Nam-Gyu Park, Alán Aspuru-Guzik, Daniel P Tabor, Jenny Nelson, James
Published in: Journal of Physics D: Applied Physics, Issue 52/1, 2019, Page(s) 013001, ISSN 0022-3727
DOI: 10.1088/1361-6463/aad926

The Role of the Side Chain on the Performance of N-type Conjugated Polymers in Aqueous Electrolytes

Author(s): Alexander Giovannitti, Iuliana P. Maria, David Hanifi, Mary J. Donahue, Daniel Bryant, Katrina J. Barth, Beatrice E. Makdah, Achilleas Savva, Davide Moia, Matyáš Zetek, Piers R.F. Barnes, Obadiah G. Reid, Sahika Inal, Garry Rumbles, George G. Malliaras, Jenny Nelson, Jonathan Rivnay, Iain McCulloch
Published in: Chemistry of Materials, Issue 30/9, 2018, Page(s) 2945-2953, ISSN 0897-4756
DOI: 10.1021/acs.chemmater.8b00321

Analysis of the Voltage Losses in CZTSSe Solar Cells of Varying Sn Content

Author(s): Mohammed Azzouzi, Antonio Cabas-Vidani, Stefan G. Haass, Jason A. Röhr, Yaroslav E. Romanyuk, Ayodhya N. Tiwari, Jenny Nelson
Published in: The Journal of Physical Chemistry Letters, 2019, Page(s) 2829-2835, ISSN 1948-7185
DOI: 10.1021/acs.jpclett.9b00506

Relating Chain Conformation to the Density of States and Charge Transport in Conjugated Polymers: The Role of the β -phase in Poly(9,9-dioctylfluorene)

Author(s): Xingyuan Shi, Vojtech Nádaždy, Aleksandr Perevedentsev, Jarvist M. Frost, Xuhua Wang, Elizabeth von Hauff, Roderick C. I. MacKenzie, Jenny Nelson
Published in: Physical Review X, Issue 9/2, 2019, ISSN 2160-3308
DOI: 10.1103/physrevx.9.021038

Factors Controlling Open-Circuit Voltage Losses in Organic Solar Cells

Author(s): Mohammed Azzouzi, Thomas Kirchartz, Jenny Nelson
Published in: Trends in Chemistry, Issue 1/1, 2019, Page(s) 49-62, ISSN 2589-5974
DOI: 10.1016/j.trechm.2019.01.010

Side-chain tuning in conjugated polymer photocatalysts for improved hydrogen production from water

Author(s): Duncan J. Woods, Sam A. J. Hillman, Drew Pearce, Liam Wilbraham, Lucas Q. Flagg, Warren Duffy, Iain McCulloch, James R. Durrant, Anne A. Y. Guilbert, Martijn A. Zwijnenburg, Reiner Sebastian Sprick, Jenny Nelson, Andrew I. Cooper
Published in: Energy & Environmental Science, 2020, ISSN 1754-5692
DOI: 10.1039/d0ee01213k

Symmetry based molecular design for triplet excitation and optical spin injection

Author(s): Anna A. Szumska, Henning Sirringhaus, Jenny Nelson
Published in: Physical Chemistry Chemical Physics, Issue 21/35, 2019, Page(s) 19521-19528, ISSN 1463-9076
DOI: 10.1039/c9cp03384j

A computational exploration of the crystal energy and charge-carrier mobility landscapes of the chiral [6]helicene molecule

Author(s): Beth Rice, Luc M. LeBlanc, Alberto Otero-de-la-Roza, Matthew J. Fuchter, Erin R. Johnson, Jenny Nelson, Kim E. Jelfs
Published in: Nanoscale, Issue 10/4, 2018, Page(s) 1865-1876, ISSN 2040-3364
DOI: 10.1039/c7nr08890f

Impact of Marginal Exciton–Charge-Transfer State Offset on Charge Generation and Recombination in Polymer:Fullerene Solar Cells

Author(s): Michelle S. Vezie, Mohammed Azzouzi, Andrew M. Telford, Thomas R. Hopper, Alexander B. Sieval, Jan C. Hummelen, Kealan Fallon, Hugo Bronstein, Thomas Kirchartz, Artem A. Bakulin, Tracey M. Clarke, Jenny Nelson
Published in: ACS Energy Letters, Issue 4/9, 2019, Page(s) 2096-2103, ISSN 2380-8195
DOI: 10.1021/acsenergylett.9b01368

Energetic Control of Redox‐Active Polymers toward Safe Organic Bioelectronic Materials

Author(s): Alexander Giovannitti, Reem B. Rashid, Quentin Thiburce, Bryan D. Paulsen, Camila Cendra, Karl Thorley, Davide Moia, J. Tyler Mefford, David Hanifi, Du Weiyuan, Maximilian Moser, Alberto Salleo, Jenny Nelson, Iain McCulloch, Jonathan Rivnay
Published in: Advanced Materials, Issue 32/16, 2020, Page(s) 1908047, ISSN 0935-9648
DOI: 10.1002/adma.201908047

Overcoming the Limitations of Transient Photovoltage Measurements for Studying Recombination in Organic Solar Cells

Author(s): Mohammed Azzouzi, Philip Calado, Andrew M. Telford, Flurin Eisner, Xueyan Hou, Thomas Kirchartz, Piers R. F. Barnes, Jenny Nelson
Published in: Solar RRL, Issue 4/5, 2020, Page(s) 1900581, ISSN 2367-198X
DOI: 10.1002/solr.201900581

Influence of Polymer Aggregation and Liquid Immiscibility on Morphology Tuning by Varying Composition in PffBT4T‐2DT/Nonfullerene Organic Solar Cells

Author(s): Zeinab Hamid, Andrew Wadsworth, Elham Rezasoltani, Sarah Holliday, Mohammed Azzouzi, Marios Neophytou, Anne A. Y. Guilbert, Yifan Dong, Mark S. Little, Subhrangsu Mukherjee, Andrew A. Herzing, Helen Bristow, R. Joseph Kline, Dean M. DeLongchamp, Artem A. Bakulin, James R. Durrant, Jenny Nelson, Iain McCulloch
Published in: Advanced Energy Materials, Issue 10/8, 2020, Page(s) 1903248, ISSN 1614-6832
DOI: 10.1002/aenm.201903248

How solar cell efficiency is governed by the αμτ product

Author(s): Pascal Kaienburg, Lisa Krückemeier, Dana Lübke, Jenny Nelson, Uwe Rau, Thomas Kirchartz
Published in: Physical Review Research, Issue 2/2, 2020, ISSN 2643-1564
DOI: 10.1103/physrevresearch.2.023109

The Effect of the Dielectric Environment on Electron Transfer Reactions at the Interfaces of Molecular Sensitized Semiconductors in Electrolytes

Author(s): Davide Moia, Masato Abe, Pawel Wagner, Hiromu Saguchi, Nagatoshi Koumura, Jenny Nelson, Piers R. F. Barnes, Shogo Mori
Published in: The Journal of Physical Chemistry C, Issue 124/13, 2020, Page(s) 6979-6992, ISSN 1932-7447
DOI: 10.1021/acs.jpcc.9b11860

Relationship between Fill Factor and Light Intensity in Solar Cells Based on Organic Disordered Semiconductors: The Role of Tail States

Author(s): Biao Xiao, Philip Calado, Roderick C.I. MacKenzie, Thomas Kirchartz, Jun Yan, Jenny Nelson
Published in: Physical Review Applied, Issue 14/2, 2020, ISSN 2331-7019
DOI: 10.1103/physrevapplied.14.024034

Structure Dependence of Kinetic and Thermodynamic Parameters in Singlet Fission Processes

Author(s): Daphné Lubert-Perquel, Anna A. Szumska, Mohammed Azzouzi, Enrico Salvadori, Stefan Ruloff, Christopher M. W. Kay, Jenny Nelson, Sandrine Heutz
Published in: The Journal of Physical Chemistry Letters, Issue 11/22, 2020, Page(s) 9557-9565, ISSN 1948-7185
DOI: 10.1021/acs.jpclett.0c02505