The HPCs behind UQ’s all-women Chemistry paper
QRIScloud-accessed Awoonga is one of the high-performance computers behind a University of Queensland all-women authored paper published recently in the “Women in Computational Chemistry” special issue of an international chemistry journal*.
The five researchers, who at the time were all based at the Centre for Theoretical and Computational Molecular Science (CTCMS) in UQ’s Australian Institute for Bioengineering and Nanotechnology (AIBN), had their paper published in the Journal of Chemical Information and Modeling on 28 May 2019.
The paper reveals certain electrode materials can be easily tuned for different reactions or temperatures, meaning hydrogen could be produced more sustainably and economically by reducing the amount of precious metals used. This has applications in making hydrogen fuel cells more sustainable, as well as for other fuel cell technologies.