I have a new publication in The Journal of Chemical Physics:
J.C. Womack, N. Mardirossian, M. Head-Gordon, and C.-K. Skylaris, “Self-consistent implementation of meta-GGA functionals for the ONETEP linear-scaling electronic structure package”, J. Chem. Phys. 145, 204114 (2016).
http://dx.doi.org/10.1063/1.4967960
I have just uploaded the slides from two recent talks I gave on my work implementing meta-GGAs in the ONETEP linear-scaling electronic structure code. The first talk was given at the RSC Theoretical Chemistry Group Conference in Nottingham, UK. The second was given at the 252nd ACS National Meeting & Exposition in Philadelphia, US. The PDFs can be downloaded from the Work page.
I have made several additions and changes:
I have just uploaded the slides from a talk I gave at the RSC Theoretical Chemistry Group Graduate Student Meeting on the 22nd April 2015 (held at the University of Manchester). This talk was awarded the Coulson Prize. The PDF can be downloaded from the Work page.
I have just uploaded the slides from a talk I gave at the University of Southampton Department of Chemistry on the 11th February 2015. The PDF can be downloaded from the Work page.
I have migrated this site to the new domain jcwomack.uk (it was formerly jwomack.co.uk). It is still hosted with wordpress.com (which has so far provided excellent service).
I have also added a brief CV, which can be downloaded from the Work page.
My first paper has been published in The Journal of Chemical Physics:
J. C. Womack & F. R. Manby, “Density fitting for three-electron integrals in explicitly correlated electronic structure theory.” J. Chem. Phys. 140, 044118 (2014). http://dx.doi.org/10.1063/1.4863136
