Closed patrickmelix closed 1 year ago
CP2K changed the MD information output format a bit, had to update the function to get the MD info. My prettify script changed a lot of formatting along the way...
I have been using it already for a while, so I am confident it works.
CP2K changed the MD information output format a bit, had to update the function to get the MD info. My prettify script changed a lot of formatting along the way...
I have been using it already for a while, so I am confident it works.