Work

 

Brief CV (PDF), further details available upon request.

Publications and reports:

  • J.C. Womack, L. Anton, J. Dziedzic, P.J. Hasnip, M.I.J. Probert, and C.-K. Skylaris, “DL_MG: A Parallel Multigrid Poisson and Poisson–Boltzmann Solver for Electronic Structure Calculations in Vacuum and Solution”, J. Chem. Theory Comput. 14, 1412 (2018).
  • J.C. Howard, J.C. Womack, J. Dziedzic, C.-K. Skylaris, B.P. Pritchard, and T.D. Crawford, “Electronically Excited States in Solution via a Smooth Dielectric Model Combined with Equation-of-Motion Coupled Cluster Theory”, J. Chem. Theory Comput. 13, 5572 (2017).
  • J.C. Womack, L. Anton, J. Dziedzic, P.J. Hasnip, M.I.J. Probert, and C.-K. Skylaris, “Implementation and Optimisation of Advanced Solvent Modelling Functionality in CASTEP and ONETEP” (ARCHER eCSE technical report, 2017).
  • N. Mardirossian, L. Ruiz Pestana, J.C. Womack, C.-K. Skylaris, T. Head-Gordon, and M. Head-Gordon, “Use of the rVV10 Nonlocal Correlation Functional in the B97M-V Density Functional: Defining B97M-rV and Related Functionals”, J. Phys. Chem. Lett. 8, 35 (2017).
  • 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).
  • J. C. Womack, and F. R. Manby, “Density fitting for three-electron integrals in explicitly correlated electronic structure theory.” J. Chem. Phys. 140, 044118 (2014).

See also, my Google Scholar and ResearchGate profiles, and my ORCID.

Ph. D. thesis:

My Ph. D. thesis can be viewed and downloaded at ResearchGate.

Talks and posters: