A Direct Approach to Crystal Structure Determination - a solution to the phase problem. The purpose of this research is to determine the positions of atoms in crystals and nano-crystals. We have developed a theory that shows how to extract all of the information required to determine atomic positions from such crystals and we have carried through initial successful tests on simple materials. In particular, we have found that crystallographic phase, hitherto not directly measurable, can in fact b ....A Direct Approach to Crystal Structure Determination - a solution to the phase problem. The purpose of this research is to determine the positions of atoms in crystals and nano-crystals. We have developed a theory that shows how to extract all of the information required to determine atomic positions from such crystals and we have carried through initial successful tests on simple materials. In particular, we have found that crystallographic phase, hitherto not directly measurable, can in fact be extracted uniquely from a single electron diffraction pattern. This constitutes a solution to the phase problem in crystallography. It is now our aim to develop this method into a routine technique.Read moreRead less
Linkage Infrastructure, Equipment And Facilities - Grant ID: LE0561233
Funder
Australian Research Council
Funding Amount
$434,000.00
Summary
State-of-the-Art Solid State Nuclear Magnetic Resonance Facility. This proposal seeks funds for the purchase and installation of a state-of-the-art 400 MHz Wide-Bore Solid-State NMR spectrometer. Research projects utilising this euipment will benefit from the ability to probe the structure of solid samples that are difficult to characterise in any other way. These materials represent advances in nanotechnology, new materials and will impact on the analysis of environmental contaminants in pota ....State-of-the-Art Solid State Nuclear Magnetic Resonance Facility. This proposal seeks funds for the purchase and installation of a state-of-the-art 400 MHz Wide-Bore Solid-State NMR spectrometer. Research projects utilising this euipment will benefit from the ability to probe the structure of solid samples that are difficult to characterise in any other way. These materials represent advances in nanotechnology, new materials and will impact on the analysis of environmental contaminants in potable water supplies, with a particular Australian focus on the identification of compounds formed as by-products during disinfection processes.
The upgraded facility will be the only one of its kind in Western Australia.
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Linkage Infrastructure, Equipment And Facilities - Grant ID: LE100100064
Funder
Australian Research Council
Funding Amount
$450,000.00
Summary
A facility for sensitive and precise isotopic dating of the earth's and extraterrestrial rocks. SPIDE2R will be a new generation mass spectrometer for very precise and sensitive dating and forensics applications in earth and planetary sciences, hydrology, climate studies, and nuclear and archaeological fingerprinting. The unprecedented sensitivity of this unique instrument will provide enhanced capabilities for solving long-standing problems requiring precise geological time resolution, as well ....A facility for sensitive and precise isotopic dating of the earth's and extraterrestrial rocks. SPIDE2R will be a new generation mass spectrometer for very precise and sensitive dating and forensics applications in earth and planetary sciences, hydrology, climate studies, and nuclear and archaeological fingerprinting. The unprecedented sensitivity of this unique instrument will provide enhanced capabilities for solving long-standing problems requiring precise geological time resolution, as well as opening new areas of research. It will be the instrument of choice for analysing small, rare samples such as those returned by space missions. The Australian-built high sensitivity source and ion detection systems can be retrofitted onto other mass spectrometers, opening a new area of commercialisation.Read moreRead less
Linkage Infrastructure, Equipment And Facilities - Grant ID: LE0237922
Funder
Australian Research Council
Funding Amount
$500,000.00
Summary
High Resolution Cryogenic Field Emission Environmental Scanning Electron Microscope Facility. A high resolution variable pressure scanning electron microscope will replace aging, heavily utilised facilities. It will be accessed by existing large and diverse user groups in a mature and internationally-recognised Centre. The novel combination of a cryogenic stage and the electrostatic beam blanking modification will support continuance of the local, world-leading research and application of new ....High Resolution Cryogenic Field Emission Environmental Scanning Electron Microscope Facility. A high resolution variable pressure scanning electron microscope will replace aging, heavily utilised facilities. It will be accessed by existing large and diverse user groups in a mature and internationally-recognised Centre. The novel combination of a cryogenic stage and the electrostatic beam blanking modification will support continuance of the local, world-leading research and application of new imaging techniques, particularly in the materials and mineral sciences. Both new nanotechnology and existing globally-significant industries will utilise the unique aspects of this instrument for product refinement and maintenance of commercial leadership, in partnership with local Universities and Government agencies.Read moreRead less
Linkage Infrastructure, Equipment And Facilities - Grant ID: LE100100118
Funder
Australian Research Council
Funding Amount
$600,000.00
Summary
Nuclear magnetic resonance spectroscopy facilities for the Sydney region. The determination of molecular structure is crucial in the chemical and biomolecular sciences, leading to the development of new drugs and other types of molecules and providing an understanding of how molecules interact with each other. The requested equipment will provide the ability for researchers in the Sydney region to advance our knowledge at this fundamental level by expanding the number and types of experiments th ....Nuclear magnetic resonance spectroscopy facilities for the Sydney region. The determination of molecular structure is crucial in the chemical and biomolecular sciences, leading to the development of new drugs and other types of molecules and providing an understanding of how molecules interact with each other. The requested equipment will provide the ability for researchers in the Sydney region to advance our knowledge at this fundamental level by expanding the number and types of experiments that can be performed.Read moreRead less
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
Understanding and controlling ion-neutral interactions. Australia faces significant environmental and technological challenges including development of clean, sustainable energy sources and technologies that do not adversely affect the terrestrial atmosphere. This project seeks to facilitate a cleaner, greener future through investigations of fundamental chemical interactions responsible for hydrogen storage in solid media, and atmospheric processes responsible for the production and destruction ....Understanding and controlling ion-neutral interactions. Australia faces significant environmental and technological challenges including development of clean, sustainable energy sources and technologies that do not adversely affect the terrestrial atmosphere. This project seeks to facilitate a cleaner, greener future through investigations of fundamental chemical interactions responsible for hydrogen storage in solid media, and atmospheric processes responsible for the production and destruction of ozone. In both cases, the key interactions between ions and neutral molecules will be elucidated through high-resolution laser studies. Ensuing experimental data will play a crucial role in controlling and predicting ion-neutral interactions in technological and environmental contexts.Read moreRead less
Towards a Microscopic Understanding of Anion Solvation. Atomic and molecular anions are ubiquitous components of oceans, rivers, lakes, and the atmosphere, and serve as key participants in natural and industrial chemical processes. In most situations ions are surrounded by a structured sheath of neutral solvent molecules which profoundly affects their physical and chemical properties. Currently, interactions between anions and solvent molecules are poorly understood. In this project we will use ....Towards a Microscopic Understanding of Anion Solvation. Atomic and molecular anions are ubiquitous components of oceans, rivers, lakes, and the atmosphere, and serve as key participants in natural and industrial chemical processes. In most situations ions are surrounded by a structured sheath of neutral solvent molecules which profoundly affects their physical and chemical properties. Currently, interactions between anions and solvent molecules are poorly understood. In this project we will use lasers to probe clusters consisting of just a few molecules attached to an anion, generating information that will enhance our ability to predict and control chemical processes involved in drug design, salination, atmospheric chemistry, and chemical waste remediation.Read moreRead less
Linkage Infrastructure, Equipment And Facilities - Grant ID: LE100100135
Funder
Australian Research Council
Funding Amount
$700,000.00
Summary
Federated single crystal X-ray structural analysis facility. X-ray crystallography is the most widely applied method for the determination of three-dimensional molecular structures. These structures range in size from small systems such as materials and pharmaceuticals through to large biological structures such as proteins. This application will provide a multidisciplinary facility covering the structural characterisation needs of chemistry, pharmacy, biology, and medicine. This will position l ....Federated single crystal X-ray structural analysis facility. X-ray crystallography is the most widely applied method for the determination of three-dimensional molecular structures. These structures range in size from small systems such as materials and pharmaceuticals through to large biological structures such as proteins. This application will provide a multidisciplinary facility covering the structural characterisation needs of chemistry, pharmacy, biology, and medicine. This will position local universities for key scientific breakthroughs that benefit the Australian community by providing improved healthcare technologies, and processes. Furthermore, access to this world-class facility will provide state-of-the-art training for undergraduate, postgraduate and postdoctoral researchers.Read moreRead less
Lighting up the charged brigade: laser spectroscopy of protonated and metal-containing complexes. Increasingly, the design of new pharmaceuticals uses computer modeling to account for the shapes of molecules and how they interact with their surroundings. The strongest forces between molecular components are those that involve charged chemical species known as ions. In this project, we will develop advanced laser-based techniques to study in unprecedented detail how molecules respond to the prese ....Lighting up the charged brigade: laser spectroscopy of protonated and metal-containing complexes. Increasingly, the design of new pharmaceuticals uses computer modeling to account for the shapes of molecules and how they interact with their surroundings. The strongest forces between molecular components are those that involve charged chemical species known as ions. In this project, we will develop advanced laser-based techniques to study in unprecedented detail how molecules respond to the presence of nearby charge, or to acquiring charge themselves. Understanding the nature of these attractions, and the structural changes that they induce eventually results in more accurate computer models. This has relevance to fields that include the architecture of proteins, recognition of signaling molecules in the brain, and drug development.Read moreRead less