Hi there,
I am a new ADF user. I want to perform atomic calculation for (C,H,O,N) for TZ2P+ basic set to to create t21.C, t21.H, t21.O, t21.N files.
How can I do it?
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The input is as follows::
#!/bin/sh
#(a)------------------------------------------
$ADFBIN/adf -n1