Thomas Keal -
Scientific Computing Department, STFC, 15585 Daresbury, Daresbury, United Kingdom of Great Britain and Northern Ireland, (e-mail: thomas.keal@stfc.ac.uk)
Alin-Marin Elena -
Scientific Computing Department, STFC, 15585 Daresbury, Daresbury, United Kingdom of Great Britain and Northern Ireland, (e-mail: alin-marin.elena@stfc.ac.uk)
Karen Stoneham -
Department of Physics, University College London, 4919 London, London, United Kingdom of Great Britain and Northern Ireland, (e-mail: k.stoneham@ucl.ac.uk)
MR Probert -
Department of Physics, University of York, 8748 York, North Yorkshire, United Kingdom of Great Britain and Northern Ireland, (e-mail: matt.probert@york.ac.uk)
Clotilde Cucinotta -
Department of Chemistry, Imperial College London, 4615 London, London, United Kingdom of Great Britain and Northern Ireland, (e-mail: c.cucinotta@imperial.ac.uk)
Andrew Logsdail -
Department of Chemistry, Cardiff University, 2112 Cardiff, South Glamorgan, United Kingdom of Great Britain and Northern Ireland, (e-mail: LogsdailA@cardiff.ac.uk)
Andrea Zen -
University of Naples Federico II, 9307 Napoli, Campania, Italy, (e-mail: andrea.zen@unina.it)
Phil Hasnip -
Department of Physics, University of York, 8748 York, North Yorkshire, United Kingdom of Great Britain and Northern Ireland, (e-mail: phil.hasnip@york.ac.uk)
Ian Bush -
Scientific Computing Department, STFC, 15585 Rutherford, Rutherford, United Kingdom of Great Britain and Northern Ireland, (e-mail: ian.bush@stfc.ac.uk)
M Watkins -
School of Mathematics and Physics, University of Lincoln, 4547 Lincoln, Lincolnshire, United Kingdom of Great Britain and Northern Ireland, (e-mail: MWatkins@lincoln.ac.uk)
Dario Alfe -
University College London, 4919 London, London, United Kingdom of Great Britain and Northern Ireland, (e-mail: d.alfe@ucl.ac.uk)
Chris-Kriton Skylaris -
Department of Chemistry, University of Southampton, 7423 Southampton, Hampshire, United Kingdom of Great Britain and Northern Ireland, (e-mail: c.skylaris@soton.ac.uk)
Basile Curchod -
Department of Chemistry, University of Durham, 3057 Durham, Durham, United Kingdom of Great Britain and Northern Ireland, (e-mail: basile.f.curchod@durham.ac.uk)
QIONG CAI
Scott Woodley -
Department of Chemistry, University College London, 4919 London, London, United Kingdom of Great Britain and Northern Ireland, (e-mail: Scott.Woodley@ucl.ac.uk)