Conjugated macrocycles for battery electrodes
Conjugated macrocycles for battery electrodes
Disciplines
Chemistry (100%)
Keywords
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Synthetic organic chemistry,
Molecular architecture and structure,
Structural properties of materials,
Method development in chemistry,
Organic battery electrodes,
Synthetic organic chemistry,
Molecular architecture and structure,
Structural properties of
Organic materials hold great promise for becoming the next generation of battery electrode materials. This project explores a fundamentally new concept for such materials, significantly improving thei r c hemical s tability a nd electronic conductivity. It bridges the gap between research on fundamental effects in organic mater ials a nd the development of ground-breaking applications. Batteries can help to reduce carbon dioxide emissions by storing clean electricity fr om r enewable s ources for periods with high demand and by making the electricity available for the tr a nsport s ector, power ing el ec tric vehicles and other means of transport. However, while batteries and electric vehicles can help to r educ e c arbon dioxide emissions, the widespread use of batteries comes at a cost. There are severe environmental a nd ethic al issues associated with lithium-ion batteries, the type of batteries dominating the electric vehicle market. Furthermore, the future supply of materials required for battery manufacturing is a concern. Most notably, lithium- ion batteries usually require cobalt for their positive electrode, which is often mi ned under ter rible wor king conditions. Organic materials are a promising alternative to electrode materials based on c obalt a nd other hea vy meta ls, considering their advantages of recyclability, structural diversity, fl ex ibility , a nd c ompatibility wi th s odium (replacing the less abundant lithium). In fact, they hold great promise for becoming the next generation of ba tter y electrode materials. However, limited electronic properties and insufficient chemical stability under fast- charge/discharge conditions still impede commercial application of these materials. To solve these issues, this project explores a fundamentally new concept for storing electricity in organic materials, based on so-called conjugated macrocycles. In particular, the research addresses the challenges of achieving high stability and capacity of the organic materials. It will further provide new synthetic strategies and design guidelines for the path towards large-scale application, with the ultimate goal of decreasing carbon dioxide emi ssions i n a n ethical and sustainable way.
Conjugated macrocycles: a promising future for organic battery technology Imagine a battery that's better for the environment, charges faster and stores more energy. That's the potential of conjugated macrocycles, a new class of organic materials explored in this research project. These materials could replace current battery electrode materials, which are often based on heavy metals and require the use of limited resources such as lithium ions. The project focused on a particular type of conjugated macrocycle called paracyclophanetetraene (PCT). The researchers discovered that PCT offers many advantages for battery electrodes. It shows remarkable stability during charge and discharge cycles, charges and discharges quickly, and can have a high energy storage capacity. PCT's unique molecular structure allows it to effectively stabilise both neutral and charged states, which is crucial for ensuring long-term functionality and efficiency in batteries. A key finding was that PCT's macrocyclic structure creates voids in the solid-state packing, which allows the material to accommodate sodium ions, contributing to its excellent performance using these more abundant and less expensive ions. However, the project did not stop at the discovery of PCT as promising material. The researchers also looked at ways to improve PCT for battery applications. By introducing different chemical groups, they were able to fine-tune properties such as stability and capacity. They also investigated methods to reduce the solubility of PCT, a key factor in preventing the electrode material from dissolving in the battery electrolyte. The results of the project show that conjugated macrocycles provide a promising new avenue for battery technology. While further research is needed for practical application, this project has laid the groundwork for significant advances in battery development.
- Technische Universität Wien - 100%
- Imperial College London - 100%
Research Output
- 80 Citations
- 20 Publications
- 13 Datasets & models
- 2 Scientific Awards
- 1 Fundings
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2024
Title Reducing undesired solubility of squarephaneic tetraimide for use as an organic battery electrode material. DOI 10.1039/d3fd00145h Type Journal Article Author Bhosale M Journal Faraday discussions Pages 129-144 -
2024
Title Organic neuromorphics and bioelectronics: general discussion. DOI 10.1039/d4fd90006e Type Journal Article Author Aitchison Cm Journal Faraday discussions Pages 83-95 -
2024
Title Organic batteries: general discussion. DOI 10.1039/d4fd90007c Type Journal Article Author Aitchison Cm Journal Faraday discussions Pages 145-161 -
2025
Title Soluble Conjugated Polymers without Side Chains: Macrocycles as Comonomers DOI 10.26434/chemrxiv-2025-jbkg8 Type Preprint Author Moro S -
2024
Title Excitonic organic materials for photochemical and optoelectronic applications: general discussion. DOI 10.1039/d4fd90008a Type Journal Article Author Aitchison Cm Journal Faraday discussions Pages 298-334 -
2021
Title The influence of alkyl group regiochemistry and backbone fluorination on the packing and transistor performance of N -cyanoimine functionalised indacenodithiophenes DOI 10.1039/d1ma00091h Type Journal Article Author Hodsden T Journal Materials Advances Pages 1706-1714 Link Publication -
2021
Title Visualisation of Chemical Shielding Tensors (VIST) to Elucidate Aromaticity and Antiaromaticity DOI 10.26434/chemrxiv.13580885.v2 Type Preprint Author Plasser F Link Publication -
2021
Title Visualisation of Chemical Shielding Tensors (VIST) to Elucidate Aromaticity and Antiaromaticity DOI 10.26434/chemrxiv.13580885 Type Preprint Author Plasser F Link Publication -
2021
Title 3D Visualisation of Chemical Shielding Tensors (VIST) to Elucidate Aromaticity and Antiaromaticity DOI 10.26434/chemrxiv.13580885.v1 Type Preprint Author Plasser F Link Publication -
2021
Title Functional Group Introduction and Aromatic Unit Variation in a Set of p-Conjugated Macrocycles: Revealing the Central Role of Local and Global Aromaticity DOI 10.26434/chemrxiv.14485002.v1 Type Preprint Author Rimmele M Link Publication -
2021
Title Functional Group Introduction and Aromatic Unit Variation in a Set of p-Conjugated Macrocycles: Revealing the Central Role of Local and Global Aromaticity DOI 10.26434/chemrxiv.14485002 Type Preprint Author Rimmele M Link Publication -
2021
Title Visualisation of Chemical Shielding Tensors (VIST) to Elucidate Aromaticity and Antiaromaticity** DOI 10.1002/ejoc.202100352 Type Journal Article Author Plasser F Journal European Journal of Organic Chemistry Pages 2529-2539 Link Publication -
2022
Title Squarephaneic Tetraanhydride: A Conjugated Square-Shaped Cyclophane for the Synthesis of Porous Organic Materials DOI 10.26434/chemrxiv-2022-p4p5d Type Preprint Author Eder S Link Publication -
2022
Title Squarephaneic Tetraanhydride: A Conjugated Square-Shaped Cyclophane for the Synthesis of Porous Organic Materials** DOI 10.1002/ange.202212623 Type Journal Article Author Eder S Journal Angewandte Chemie Link Publication -
2022
Title Squarephaneic Tetraanhydride: A Conjugated Square-Shaped Cyclophane for the Synthesis of Porous Organic Materials** DOI 10.1002/anie.202212623 Type Journal Article Author Eder S Journal Angewandte Chemie International Edition Link Publication -
2022
Title Post-polymerisation approaches for the rapid modification of conjugated polymer properties DOI 10.1039/d2mh00519k Type Journal Article Author Rimmele M Journal Materials Horizons Pages 2678-2697 Link Publication -
2022
Title [2.2.2.2]Paracyclophanetetraenes (PCTs): cyclic structural analogues of poly( p-phenylene vinylene)s (PPVs) DOI 10.12688/openreseurope.13723.2 Type Journal Article Author Pletzer M Journal Open Research Europe Pages 111 Link Publication -
2021
Title Functional group introduction and aromatic unit variation in a set of p-conjugated macrocycles: revealing the central role of local and global aromaticity DOI 10.1039/d1qo00901j Type Journal Article Author Rimmele M Journal Organic Chemistry Frontiers Pages 4730-4745 Link Publication -
2021
Title [2.2.2.2]Paracyclophanetetraenes (PCTs): cyclic structural analogues of poly(p-phenylene vinylene)s (PPVs) DOI 10.12688/openreseurope.13723.1 Type Journal Article Author Pletzer M Journal Open Research Europe Pages 111 Link Publication -
2023
Title Functionalisation of conjugated macrocycles with type I and II concealed antiaromaticity via cross-coupling reactions. DOI 10.1039/d3me00045a Type Journal Article Author Bennett Tlr Journal Molecular systems design & engineering Pages 713-720
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2023
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Title CCDC 2170729: Experimental Crystal Structure Determination DOI 10.5517/ccdc.csd.cc2bvtjk Type Database/Collection of data Public Access Link Link -
2023
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Title CCDC 2170730: Experimental Crystal Structure Determination DOI 10.5517/ccdc.csd.cc2bvtkl Type Database/Collection of data Public Access Link Link -
2023
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Title Research Data for "Functionalisation of conjugated macrocycles with Type I and II concealed antiaromaticity via cross-coupling reactions" DOI 10.17028/rd.lboro.22306207.v1 Type Database/Collection of data Public Access Link Link -
2023
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Title Research Data for "Reducing Undesired Solubility of Squarephaneic Tetraimide for Use as an Organic Battery Electrode Material" DOI 10.17028/rd.lboro.23685903 Type Database/Collection of data Public Access Link Link -
2022
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Title Research data for "[2.2.2.2]Paracyclophanetetraenes (PCTs): cyclic structural analogues of poly(p-phenylene vinylene)s (PPVs)" DOI 10.5281/zenodo.5206264 Type Database/Collection of data Public Access Link Link -
2022
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Title Research data for "[2.2.2.2]Paracyclophanetetraenes (PCTs): cyclic structural analogues of poly(p-phenylene vinylene)s (PPVs)" DOI 10.5281/zenodo.6323475 Type Database/Collection of data Public Access Link Link -
2022
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Title Supplementary information files for Visualisation of Chemical Shielding Tensors (VIST) to Elucidate Aromaticity and Antiaromaticity DOI 10.17028/rd.lboro.19794796 Type Database/Collection of data Public Access Link Link -
2021
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Title CCDC 2050898: Experimental Crystal Structure Determination DOI 10.5517/ccdc.csd.cc26v407 Type Database/Collection of data Public Access Link Link -
2021
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Title CCDC 2050899: Experimental Crystal Structure Determination DOI 10.5517/ccdc.csd.cc26v418 Type Database/Collection of data Public Access Link Link -
2021
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Title Research data for "[2.2.2.2]Paracyclophanetetraenes (PCTs): cyclic structural analogues of poly(p-phenylene vinylene)s (PPVs)" DOI 10.5281/zenodo.5206265 Type Database/Collection of data Public Access Link Link -
2021
Link
Title Research Data for "3D Visualisation of chemical shielding tensors (VIST) to elucidate local and global (anti)aromaticity" DOI 10.17028/rd.lboro.13546826 Type Database/Collection of data Public Access Link Link -
2021
Link
Title Research Data for "Functional Group Introduction and Aromatic Unit Variation in a Set of π-Conjugated Macrocycles: Revealing the Central Role of Local and Global Aromaticity" DOI 10.17028/rd.lboro.14500482 Type Database/Collection of data Public Access Link Link -
2021
Link
Title Research Data for "Functional Group Introduction and Aromatic Unit Variation in a Set of π-Conjugated Macrocycles: Revealing the Central Role of Local and Global Aromaticity" DOI 10.17028/rd.lboro.14500482.v1 Type Database/Collection of data Public Access Link Link
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2024
Title Thieme Chemistry Journals Award Type Research prize Level of Recognition Continental/International -
2021
Title Rising Star, Freiburg Rising Stars Academy, University of Freiburg Type Awarded honorary membership, or a fellowship, of a learned society Level of Recognition Continental/International
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2021
Title Multielectron photoredox catalysts based on charge accumulation in conjugated macrocycles Type Research grant (including intramural programme) Start of Funding 2021 Funder Engineering and Physical Sciences Research Council (EPSRC)