Author Topic: PDOS has no effect  (Read 2851 times)

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Offline perfetti

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PDOS has no effect
« on: May 2, 2012, 17:15 »
Dear everyone,
        I did scf calculation for the device and stored it in a nc file. And then I did DOS calculation using analysis from file. However, I could not use atom indices nor shells to project the dos on a certain atoms. Input indices has no effect and ticking the shells doesn't cause any reaction.
        I am using the demo edition of 12.2. Could anyone give an advice on this?

« Last Edit: May 2, 2012, 17:27 by perfetti »

Offline Nordland

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Re: PDOS has no effect
« Reply #1 on: May 2, 2012, 22:18 »
In the dialog were you can select the file in the PDOS widget, select the file where your self-consistent calculation is stored, and it works.