Dear VASP,
I ran a relax calculation. I'm quite confused about the difference between the atomic energy = 14981eV and energy without entropy = -116eV. Also, why is the atomic energy a positive number?
Thanks in advance.
An ignorant student
Atomic energy vs. Total energy
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pillow47
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Atomic energy vs. Total energy
Last edited by pillow47 on Wed May 29, 2013 7:19 am, edited 1 time in total.
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support_vasp
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Re: Atomic energy vs. Total energy
Hi,
We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.
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