A paper summarizing the capabilities and developments in the CP2K atomistic software suite has just been published in the Journal of Chemical Physics as the editor’s choice. Lincoln’s contribution was to the excited state TDDFT code that Sergey Chulkov worked on in recent projects. Thanks to Thomas Kuhne for organising the many contributions!

It is part of a special issue of JCP on electronic structure theory with papers from many of the leading materials simulation codes, all free to read for the near future.