[Pw_forum] molecular orbital
somayeh fotohi
somayehfotohi at yahoo.com
Fri Nov 16 21:49:49 CET 2012
dear quantum espresso users,
I have one question about molecular orbitals.
I run the code scf.in and nscf.in with quantum espresso then disentangle.x ,wanneir.x and plot.x using WANT package.
I want to show many molecular orbital by xcrysden but i see one molecular orbital per atom each time .
how plot many molecular orbital at simultaneously by xcrysden?
Thanks in advance for your reply and help.
best regards.
somayeh fotoohi
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