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Total Energy Interpretation? Total Energy per Unit Cell or per Atom or per bulk.
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Topic: Total Energy Interpretation? Total Energy per Unit Cell or per Atom or per bulk. (Read 350 times)
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Ash
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Total Energy Interpretation? Total Energy per Unit Cell or per Atom or per bulk.
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May 22, 2012, 18:54 »
Hi everyone,
Can someone please explain me the interpretation of 'Total Energy' ? Is it the total energy per Unit Cell or per atom or per whole bulk repeated infinitely as unit cell does ?
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Nordland
QuantumWise Staff
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Re: Total Energy Interpretation? Total Energy per Unit Cell or per Atom or per bulk.
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May 22, 2012, 22:03 »
It is the per unit cell. So if you repeat the system 2x2x2 you will get 8 times the energy.
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Ash
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Re: Total Energy Interpretation? Total Energy per Unit Cell or per Atom or per bulk.
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Reply #2 on:
May 23, 2012, 05:14 »
Thanks !! That's what I was about to ask next
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