xps spectra in vasp

Queries about input and output files, running specific calculations, etc.


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shyam
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xps spectra in vasp

#1 Post by shyam » Mon Sep 02, 2013 10:38 am

Dear sir,
Can we plot xps spectra with vasp.
If yes then please guide me for this.
Thanks
Last edited by shyam on Mon Sep 02, 2013 10:38 am, edited 1 time in total.

admin
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xps spectra in vasp

#2 Post by admin » Tue Sep 03, 2013 10:01 am

you can calculate core levels and core level shifts, please have a look for the ICORELEVEL tag in the manual (please however note that core level
shifts were NOT fully tested for vasp.4.6)
Last edited by admin on Tue Sep 03, 2013 10:01 am, edited 1 time in total.

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