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Hi, is it possible to generate all input files via DFT-calculations? Cheers, Momin -- Momin Ahmad Karlsruhe Institute of Technology (KIT) Steinbuch Centre for Computing (SCC) Hermann-von-Helmholtz-Platz 1 76344 Eggenstein-Leopoldshafen Phone: +49 721 608-24286 E-Mail: [log in to unmask] ######################################################################## To unsubscribe from the DLPOLY list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/webadmin?SUBED1=DLPOLY&A=1