Greetings : I am trying to use this function "BEEF-vdW" I am following the link below for instructions https://github.com/vossjo/ase-espresso/wiki <https://mail.kustar.ac.ae/owa/redir.aspx?C=24k4WMLWiNxnRzKq9_xdcdii58KaeCXNKVt0JPG-gaFX8ksHmPXXCA..&URL=https%3a%2f%2fgithub.com%2fvossjo%2fase-espresso%2fwiki> As per my understanding ase-espresso will generate the input file with the custom espsite.py and as I know adding input_dft="BEEF-vdW" to the input file will not help. I need to know how to generate the input file with espsite.py or with cubecutperiodic / pwlog2trajectory ?"
Thanks Malathe Khalifa University
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