X-RAY DIFFRACTION CAPABILITY FOR NANOSCALE AND THIN FILM STRUCTURE
Lead Research Organisation:
University of Liverpool
Department Name: Physics
Abstract
The specific arrangements of matter at the atomic scale gives advance functional materials their unique properties. Therefore, the future in materials design relies on our ability to control nanoscale structures. To achieve this, a vital tool for material scientist is x-ray diffraction as it allows in-depth characterisation of the crystal structure.
Here we propose to establish an x-ray diffractometer dedicated to nanoscale and thin film structure with a set of capabilities which will enable material scientist to study the structural properties of polycrystalline and epitaxial films and probe the interface quality and structure which often dictates the performance and functionality of the nanoscale material. The high throughput capability offered by this equipment will play a vital role in atomic scale design of functional materials and process optimisation for integration in device. It will enable the routine measurement of phase purity, crystalline quality, thickness and roughness using non-destructive method. More advanced measurements will be used to determine epitaxial relationship and texture of the nanostructures. The materials studied have applications in renewable energy (photovoltaic, battery, thermoelectric), electronic (transparent conducting oxides, dielectrics, semiconductor alloys)
Here we propose to establish an x-ray diffractometer dedicated to nanoscale and thin film structure with a set of capabilities which will enable material scientist to study the structural properties of polycrystalline and epitaxial films and probe the interface quality and structure which often dictates the performance and functionality of the nanoscale material. The high throughput capability offered by this equipment will play a vital role in atomic scale design of functional materials and process optimisation for integration in device. It will enable the routine measurement of phase purity, crystalline quality, thickness and roughness using non-destructive method. More advanced measurements will be used to determine epitaxial relationship and texture of the nanostructures. The materials studied have applications in renewable energy (photovoltaic, battery, thermoelectric), electronic (transparent conducting oxides, dielectrics, semiconductor alloys)
Planned Impact
The new x-ray diffraction instrument that is requested in this application underpins a large number of scientific programs. The underlying capabilities enabled by the equipment are vital for the development of advanced functional materials which have been recognised as one of the UK "Eight great technologies". The impact of the proposed equipment will be in the following areas:
(1) Economy
The non-destructive high throughput characterisation of nanostructures enabled by the proposed equipment is central to the discovery of advanced functional materials and its integration in the supply chain in surface engineering and advanced films & coatings will enable accelerated commercialisation of novel devices and lead to the development of new technologies. This will be accompanied by job creation and enhance the future competiveness of the UK industry in the field of advanced functional materials. Usage of the proposed equipment will contribute to this development through generating knowledge and intellectual property that will be exploited in this long-term development.
(2) Society
The fundamental principle behind the requested equipment, x-ray scattering, is widely used in everyday medical application. Linking large scale facilities such as synchrotron radiation sources to this physical principle will contribute in educating the wider society on the possibilities to explore the atomic scale arrangement of matter. We have a successful strategy for outreach event using the EPSRC mid-range facility XMaS with a particular focus on tackling the gender bias in Physics.
(3) Knowledge Exchange
The project will train young researchers who will acquire the necessary skills to contribute to the future economic development outlined above. These skills will include specific knowledge in x-ray scattering method as well as more generic skills such as effective communication, project and time management.
(1) Economy
The non-destructive high throughput characterisation of nanostructures enabled by the proposed equipment is central to the discovery of advanced functional materials and its integration in the supply chain in surface engineering and advanced films & coatings will enable accelerated commercialisation of novel devices and lead to the development of new technologies. This will be accompanied by job creation and enhance the future competiveness of the UK industry in the field of advanced functional materials. Usage of the proposed equipment will contribute to this development through generating knowledge and intellectual property that will be exploited in this long-term development.
(2) Society
The fundamental principle behind the requested equipment, x-ray scattering, is widely used in everyday medical application. Linking large scale facilities such as synchrotron radiation sources to this physical principle will contribute in educating the wider society on the possibilities to explore the atomic scale arrangement of matter. We have a successful strategy for outreach event using the EPSRC mid-range facility XMaS with a particular focus on tackling the gender bias in Physics.
(3) Knowledge Exchange
The project will train young researchers who will acquire the necessary skills to contribute to the future economic development outlined above. These skills will include specific knowledge in x-ray scattering method as well as more generic skills such as effective communication, project and time management.
Publications

Birkett M
(2018)
Band gap temperature-dependence of close-space sublimation grown Sb2Se3 by photo-reflectance
in APL Materials

Cao Z
(2019)
Influence of annealing on the electrical characteristic of GaSbBi Schottky diodes
in Journal of Applied Physics

Featherstone T
(2018)
Transparent Ta doped SnO2 films deposited by RF co-sputtering

Fernández-Vidal J
(2022)
Long-Life and pH-Stable SnO2-Coated Au Nanoparticles for SHINERS.
in The journal of physical chemistry. C, Nanomaterials and interfaces

Fleck N
(2020)
How Oxygen Exposure Improves the Back Contact and Performance of Antimony Selenide Solar Cells.
in ACS applied materials & interfaces

Fleck N
(2020)
Identifying Raman modes of Sb 2 Se 3 and their symmetries using angle-resolved polarised Raman spectra
in Journal of Materials Chemistry A

Gibson QD
(2021)
Low thermal conductivity in a modular inorganic material with bonding anisotropy and mismatch.
in Science (New York, N.Y.)

Keeney L
(2020)
Persistence of Ferroelectricity Close to Unit-Cell Thickness in Structurally Disordered Aurivillius Phases
in Chemistry of Materials

Murgatroyd P
(2021)
Chemically Controllable Magnetic Transition Temperature and Magneto-Elastic Coupling in MnZnSb Compounds
in Advanced Functional Materials

Murgatroyd PAE
(2020)
GeSe: Optical Spectroscopy and Theoretical Study of a van der Waals Solar Absorber.
in Chemistry of materials : a publication of the American Chemical Society
Description | The primary objective of this grant was to establish a new x-ray diffraction facility at the University of Liverpool with the procurement of a state-of-the-art instrument. The new diffractometer has been delivered and fully commissioned (see url for details) in February 2017. Users from several group across the chemistry, physics and engineering have been trained and the PI together with the School of Physical Science are piloting a new Shared Research Facility scheme based on this equipment. The facility is fully operational with more than 40 users from UoL. |
Exploitation Route | The primary objective as been achieved and the facility is operational. The success of the facility has led to an expansion of activity by adding XPS and powder diffraction. |
Sectors | Other |
URL | http://www.scimed.co.uk/rigaku-9kw-smartlab-xrd-installation-university-liverpool/ |
Description | International Exchanges 2019 Cost Share |
Amount | £12,000 (GBP) |
Funding ID | IEC\R1\191040 |
Organisation | The Royal Society |
Sector | Charity/Non Profit |
Country | United Kingdom |
Start | 08/2019 |
End | 09/2021 |
Description | Lynette Keeney (Tyndall-UCC) |
Organisation | University College Cork |
Department | Tyndall National Institute |
Country | Ireland |
Sector | Academic/University |
PI Contribution | The x-ray suite procured in this grant was used to characterise epitaxial thin films using x-ray reflectivity, reciprocal space map and pole figure. |
Collaborator Contribution | The partner provided epitaxial thin films of potential room temperature multiferroic materials. |
Impact | None so far. |
Start Year | 2019 |
Description | Phil King XRD |
Organisation | University of St Andrews |
Department | School of Physics and Astronomy |
Country | United Kingdom |
Sector | Academic/University |
PI Contribution | We are assessing the quality and thickness of films grown by MBE. |
Collaborator Contribution | They are providing samples suitable to be measured in the diffractometer purchased with this award. |
Impact | This collaboration is allowing for the optimization of complex inorganic materials growth. |
Start Year | 2017 |
Description | Rigaku workshop |
Form Of Engagement Activity | Participation in an activity, workshop or similar |
Part Of Official Scheme? | No |
Geographic Reach | International |
Primary Audience | Professional Practitioners |
Results and Impact | During this workshop our team was able to presents the facility which has been setup at the University of Liverpool from this award and discussions with other academics led to possible collaborations. |
Year(s) Of Engagement Activity | 2017 |