How calculate diffusion coefficient using dump file?

[simongravelle]

Please also try not to post multiple questions under the same topic:

@akohlmey

when you have a new question, you don’t add it to an existing discussion but start a new topic with a corresponding new subject line, so that people can see if this is a topic they are interested in or have something to add to. by doing what you did, you are significantly reducing your chances for an on-topic response! so it is in your own best interest.