A reliable physical model of molecular motion in crystals. The scientific benefits would flow, in the first instance, to the large national and international communities of scientists whose research makes use of the results of X-ray diffraction experiments. Applications of the research to amino acids and peptides will benefit investigations into the structure and molecular dynamics of biological systems, including proteins and enzymes. Studies of charge densities in crystals will obtain a standa ....A reliable physical model of molecular motion in crystals. The scientific benefits would flow, in the first instance, to the large national and international communities of scientists whose research makes use of the results of X-ray diffraction experiments. Applications of the research to amino acids and peptides will benefit investigations into the structure and molecular dynamics of biological systems, including proteins and enzymes. Studies of charge densities in crystals will obtain a standard tool for improved modelling of molecular motion, resulting in physically more realistic charge density functions, and hence greater insight into the relationship between properties of crystals and their constituent molecules.Read moreRead less
Electronic and Optical Properties of Doped Titanium Dioxide. Titanium dioxide, is widely used as a white pigment, owing to its high refractive index, second, only after diamond. Yellowing of rutile pigment particles, observed on prolonged exposure to sunlight, is a serious problem that pigment manufacturers would like to overcome. It is proposed that aluminium-doping of rutile limits this discolouration by altering the electronic structure of the rutile particles. This project seeks to identify ....Electronic and Optical Properties of Doped Titanium Dioxide. Titanium dioxide, is widely used as a white pigment, owing to its high refractive index, second, only after diamond. Yellowing of rutile pigment particles, observed on prolonged exposure to sunlight, is a serious problem that pigment manufacturers would like to overcome. It is proposed that aluminium-doping of rutile limits this discolouration by altering the electronic structure of the rutile particles. This project seeks to identify the specific electronic cause of the yellowing process, the nature of the Al defect,it's effect on the electronic structure of rutile, and the electronic perturbations that may occur when other dopants are used.Read moreRead less
Linkage Infrastructure, Equipment And Facilities - Grant ID: LE110100093
Funder
Australian Research Council
Funding Amount
$600,000.00
Summary
Shared laser facility. This shared laser facility will provide a pool of lasers to support the research of about 20 research groups and 30 PhD students.
Better Batteries via Controlling the Properties of Electrolytic Manganese Dioxide. Physical properties of electrolytic manganese dioxide (EMD) such as crystal structure, morphology and electrochemical characteristics determine its usefulness in alkaline batteries. However, the relationship between these parameters is not well understood. This APAI project will attempt to address these shortcomings in the current understanding of the production process by focussing on the relationships between fu ....Better Batteries via Controlling the Properties of Electrolytic Manganese Dioxide. Physical properties of electrolytic manganese dioxide (EMD) such as crystal structure, morphology and electrochemical characteristics determine its usefulness in alkaline batteries. However, the relationship between these parameters is not well understood. This APAI project will attempt to address these shortcomings in the current understanding of the production process by focussing on the relationships between fundamental physical, chemical and electrochemical properties of EMD. The results will be of benefit in optimising the process and ensuring that EMD with superior performance can be consistently produced.Read moreRead less
Linkage Infrastructure, Equipment And Facilities - Grant ID: LE0775551
Funder
Australian Research Council
Funding Amount
$550,000.00
Summary
Integrated Advanced X-ray Diffraction Facility. The new equipment will provide a unique facility for single crystal, powder and thin film structure elucidation using X-ray diffraction techniques. No other techniques have the capabilities in structure determination of materials at an atomic level which are necessary for delivering applications in nano-technology, health care products, amongst many fields, for the benefit for the community at large. The facility will foster a more innovative resea ....Integrated Advanced X-ray Diffraction Facility. The new equipment will provide a unique facility for single crystal, powder and thin film structure elucidation using X-ray diffraction techniques. No other techniques have the capabilities in structure determination of materials at an atomic level which are necessary for delivering applications in nano-technology, health care products, amongst many fields, for the benefit for the community at large. The facility will foster a more innovative research culture and provide excellent research training at the highest international level, and will provide a platform to maximise access to the new Opal Research Reactor and Australian Synchrotron.Read moreRead less
Electrostatic complementarity: A unifying principle in molecular crystal structures. Many technological advances are underpinned by the development of crystalline materials with desired physical properties. By exploring and quantifying the concept of 'electrostatic complementarity' in crystal packing, the project will give researchers access to a powerful suite of tools to assist in the greater understanding of intermolecular interactions.
Host-guest interactions in the solid state: models for an enhanced understanding of supramolecular chemistry. Molecular aggregates involving host and guest molecules underpin the design and development of functional materials in areas as diverse as catalysis, targeted drug delivery and gas storage. Project outcomes will facilitate the rationalisation and prediction of their properties and inspire future development of these important materials.
Taming carbon dioxide: Molecular interactions in the solid state. This project aims to investigate what features of host-guest systems are needed to encapsulate carbon dioxide in the solid state, particularly organic interactions guided by solid state observations. Technologies that reduce and manipulate atmospheric carbon dioxide will rely on understanding the intermolecular interactions between volatile molecules and designed substrates. This project will use structural chemistry, accurate X-r ....Taming carbon dioxide: Molecular interactions in the solid state. This project aims to investigate what features of host-guest systems are needed to encapsulate carbon dioxide in the solid state, particularly organic interactions guided by solid state observations. Technologies that reduce and manipulate atmospheric carbon dioxide will rely on understanding the intermolecular interactions between volatile molecules and designed substrates. This project will use structural chemistry, accurate X-ray diffraction data, complementary neutron diffraction experiments, quantum chemical calculations and computer graphics. These observations are expected to guide the synthesis of more efficient hosts.Read moreRead less
Light Activated Electrochemistry: Microelectrode Arrays with just one wire. Electrochemistry requires each electrode to be connected to the external circuit by a wire. With many electrodes this means many wires. Wires limit electrode density in arrays and dictate that the electrode architecture must be predetermined. This project aims to remove the need for a wire for each electrode by using light to sequentially connect each electrode to a single wire. This will be achieved using modified silic ....Light Activated Electrochemistry: Microelectrode Arrays with just one wire. Electrochemistry requires each electrode to be connected to the external circuit by a wire. With many electrodes this means many wires. Wires limit electrode density in arrays and dictate that the electrode architecture must be predetermined. This project aims to remove the need for a wire for each electrode by using light to sequentially connect each electrode to a single wire. This will be achieved using modified silicon electrodes where irradiating with light causes an increase in conductivity at the illumination spot. The project will explore the variables that influence the spatial resolution and apply the ideas to making soft connects for nanoelectronics and making high density electrode arrays for electroanalysis.Read moreRead less