Organometallic Transformations of Organic Compounds. The program will develop new metal-based catalysts for two main purposes (i) transforming basic hydrocarbons eg. natural gas and low-molecular-weight petroleum products into more advanced compounds (such as alcohols, alkenes and carboxylic acids); and (ii) converting nitrogen gas into nitrogen-containing compounds eg. ammonia or ammonia derivatives. In both projects, the aim is to take readily available and abundant starting materials that ar ....Organometallic Transformations of Organic Compounds. The program will develop new metal-based catalysts for two main purposes (i) transforming basic hydrocarbons eg. natural gas and low-molecular-weight petroleum products into more advanced compounds (such as alcohols, alkenes and carboxylic acids); and (ii) converting nitrogen gas into nitrogen-containing compounds eg. ammonia or ammonia derivatives. In both projects, the aim is to take readily available and abundant starting materials that are currently difficult to utilise and to design and develop specific reagents to convert them to "value-added" products. The program will also explore the mode of action of metal-based reagents leading to better reagent and catalyst design.Read moreRead less
New Methods to Harvest Light: Towards Better Dye-Sensitized Solar Cells. Dye-sensitized solar cell (DSC) technology has emerged as a complementary energy source to silicon photovoltaic technology. The efficiency of the DSC relies heavily on sensitizing molecules to absorb solar photons and then transfer electrons to a semi-conducting particle. This project will investigate new sensitizing methods using a combination of different dyes which work cooperatively to absorb a large part of the solar ....New Methods to Harvest Light: Towards Better Dye-Sensitized Solar Cells. Dye-sensitized solar cell (DSC) technology has emerged as a complementary energy source to silicon photovoltaic technology. The efficiency of the DSC relies heavily on sensitizing molecules to absorb solar photons and then transfer electrons to a semi-conducting particle. This project will investigate new sensitizing methods using a combination of different dyes which work cooperatively to absorb a large part of the solar spectrum and efficiently inject electrons into a semi-conducting particles. The development and understanding of these new methods to sensitize the dye-sensitized solar cell should lead to new and better solar cells.Read moreRead less
Advanced Molecular Frameworks for Sodium Battery Electrode Applications. This project aims to develop new molecular materials capable of high capacity sodium-ion insertion. Through an innovative interdisciplinary approach that targets the synthesis and detailed characterisation of an extensive family of materials this project expects to generate major advances in the understanding of how the chemical, physical and structural attributes of the materials relate to their electrical charge/discharge ....Advanced Molecular Frameworks for Sodium Battery Electrode Applications. This project aims to develop new molecular materials capable of high capacity sodium-ion insertion. Through an innovative interdisciplinary approach that targets the synthesis and detailed characterisation of an extensive family of materials this project expects to generate major advances in the understanding of how the chemical, physical and structural attributes of the materials relate to their electrical charge/discharge behaviours. Significant anticipated outcomes and benefits include the development of new material design approaches that optimise battery electrode performance across a diverse parameter space, and the generation of advanced new materials worthy of commercial development in low-cost, large-scale battery applications.Read moreRead less
A Radical Approach to Multifunctional Coordination Solids. The development of multifunctional coordination solids represents one of the foremost challenges in the field of advanced materials as their properties underpin the next generation of technologically useful devices. Using a highly targeted theoretical and experimental approach for crystal engineering, this project aims to generate coordination solids that integrate radicals as molecular components for charge transfer. At a fundamental le ....A Radical Approach to Multifunctional Coordination Solids. The development of multifunctional coordination solids represents one of the foremost challenges in the field of advanced materials as their properties underpin the next generation of technologically useful devices. Using a highly targeted theoretical and experimental approach for crystal engineering, this project aims to generate coordination solids that integrate radicals as molecular components for charge transfer. At a fundamental level these materials will offer unprecedented insights into charge delocalisation and radical-induced switching phenomena in three-dimensional coordination space. It is expected that the outcomes of the project will spur the development of devices for applications ranging from solid state sensing to energy conversion and storage.Read moreRead less
Selective photocatalytic lignin biomass conversion. If the prospective ‘hydrogen economy’ is to use hydrogen as a fuel and energy carrier to replace fossil sources, vast amounts of renewable cheap hydrogen must be available. A likely candidate is catalytic water splitting by sunlight. The hydrogen can be made affordable, by coupling hydrogen production to a higher value-added stream. The aim of this project is to produce a stable, hybrid heterogenous catalyst system able to oxidise organic subst ....Selective photocatalytic lignin biomass conversion. If the prospective ‘hydrogen economy’ is to use hydrogen as a fuel and energy carrier to replace fossil sources, vast amounts of renewable cheap hydrogen must be available. A likely candidate is catalytic water splitting by sunlight. The hydrogen can be made affordable, by coupling hydrogen production to a higher value-added stream. The aim of this project is to produce a stable, hybrid heterogenous catalyst system able to oxidise organic substrates derived from lignin biomass as an adjunct to visible light hydrogen generation from water. The significance will be to provide fuels and organic chemicals for industry from biomass, water and sunlight and catalytically remediate waste water with sunlight.Read moreRead less
Light driven supramolecular reactors. A major problem facing synthetic chemistry is how to control chemical reactivity using benign techniques. The aim of this project is to form supramolecular capsules that can bind guest molecules and use visible light to drive chemical reactions inside these cages. This project aims to develop the first examples of molecular cages that are able to catalyse photoredox processes. These enantiopure, self-assembled cages will be based on ruthenium(II) complexes w ....Light driven supramolecular reactors. A major problem facing synthetic chemistry is how to control chemical reactivity using benign techniques. The aim of this project is to form supramolecular capsules that can bind guest molecules and use visible light to drive chemical reactions inside these cages. This project aims to develop the first examples of molecular cages that are able to catalyse photoredox processes. These enantiopure, self-assembled cages will be based on ruthenium(II) complexes with established photophysical properties. The expected outcomes will include the first proof-of-principle examples of controlled photoredox reactions, opening the door for the development of enantioselective molecular photoreactors.Read moreRead less
Cooperativity in Spin Crossover Systems: Memory, Magnetism and Microporosity. Spin-crossover centres are a well known form of inorganic electronic switch for which variation of temperature, pressure and irradiation leads to a change in d-electron configuration and therefore changes to structure, colour and magnetism. Here we aim to synthesise and study a wide variety of new spin-crossover systems where cooperativitiy between centres, induced by careful supramolecular design, will lead to molecul ....Cooperativity in Spin Crossover Systems: Memory, Magnetism and Microporosity. Spin-crossover centres are a well known form of inorganic electronic switch for which variation of temperature, pressure and irradiation leads to a change in d-electron configuration and therefore changes to structure, colour and magnetism. Here we aim to synthesise and study a wide variety of new spin-crossover systems where cooperativitiy between centres, induced by careful supramolecular design, will lead to molecules and materials having memory retention, magnetic ordering and/or microporosity. The significance of these aims covers several fundamental questions in the science of electronic systems. We also identify a number of potential nanochemical switching applications for the unique systems proposed.Read moreRead less
Dinuclear Ruthenium Complexes as Sequence- and Structure-Selective Binding Agents for DNA. Studies of the interaction of mononuclear metal complexes with DNA have greatly increased our understanding of the ways that small molecules recognise particular sites on DNA. However, in order to design drugs that target specific genes, and hence be potentially capable of controlling gene expression, it is necessary to study the binding of metal complexes that can associate with larger segments of DNA. ....Dinuclear Ruthenium Complexes as Sequence- and Structure-Selective Binding Agents for DNA. Studies of the interaction of mononuclear metal complexes with DNA have greatly increased our understanding of the ways that small molecules recognise particular sites on DNA. However, in order to design drugs that target specific genes, and hence be potentially capable of controlling gene expression, it is necessary to study the binding of metal complexes that can associate with larger segments of DNA. Using the combined expertise of the applicants, it is proposed to stereospecifically synthesise dinuclear complexes and study their DNA binding. This will greatly assist in the development of drugs that can selectively target genes and altered DNA.Read moreRead less
Polynuclear Spin-Crossover Molecular Switches: Host-Guest Chemistry, Magnetism and Memory. The generation of advanced nanomaterials requires both a control of nanoscale structure and the incorporation of specific properties into that structure. This project will lead to significant new developments in this area, with the assembly of complex molecular systems containing electronic switches. The unique combination of nanoscale switching and guest-binding and/or magnetic ordering in these systems ....Polynuclear Spin-Crossover Molecular Switches: Host-Guest Chemistry, Magnetism and Memory. The generation of advanced nanomaterials requires both a control of nanoscale structure and the incorporation of specific properties into that structure. This project will lead to significant new developments in this area, with the assembly of complex molecular systems containing electronic switches. The unique combination of nanoscale switching and guest-binding and/or magnetic ordering in these systems will lead to entirely new materials properties, leading in turn to fundamental advances in the science of molecular electronics and nanomaterials. Benefits of the research are wide-ranging, and include the development of innovative new technologies for molecular sensing, molecular separations, data storage and visual displays.Read moreRead less
Adding hydride punch to transition metal complexes for CO2 electroreduction. This project plans to apply an innovative methodology to the selective conversion of carbon dioxide (CO2) waste into useful C1 chemicals. The new inorganic chemistry approach is based on the invention of transition metal–organic hydride coordination complexes, which are designed to punch hydride ion (= a proton and two electrons) into metal-activated CO2-derived intermediates. The approach should naturally overcome the ....Adding hydride punch to transition metal complexes for CO2 electroreduction. This project plans to apply an innovative methodology to the selective conversion of carbon dioxide (CO2) waste into useful C1 chemicals. The new inorganic chemistry approach is based on the invention of transition metal–organic hydride coordination complexes, which are designed to punch hydride ion (= a proton and two electrons) into metal-activated CO2-derived intermediates. The approach should naturally overcome the two-electron barrier found for today's best transition metal electrocatalysts of CO2 reduction and, hence, enable the selective production of formaldehyde, a four-electron reduction product and bulk industrial feedstock chemical, or methanol, a six-electron reduction product and future transport fuel.Read moreRead less