DOS dependence on cell size
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DOS dependence on cell size
Hi
My DOS results for pure Ni unit cell (Ni slab) is different from the case the unit cell repeated to make a 3*3*1 super cell. I'm wondering what the reason is? The DOS at fermi level for the supercell is is almost three times as large as it for the unit cell.
My DOS results for pure Ni unit cell (Ni slab) is different from the case the unit cell repeated to make a 3*3*1 super cell. I'm wondering what the reason is? The DOS at fermi level for the supercell is is almost three times as large as it for the unit cell.
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- Global Moderator
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Re: DOS dependence on cell size
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