Dear all users, Recently I have done some PDOS calculation on graphane, The problem is that for those occupied states, the total PDOS of all atoms equals well with that given in the .pdos.pdos.tot, while, for those unoccupied states, the total PDOS of all atoms is about half of that given in .pdos.pdos.tot. Does anyone encounter similar problems ? Any suggestions will be greatly appreciated.
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