[QE-users] Inconsistent total energy between different version

[Duy Le]

Thank Kevin,

That would explain it. It was my bad that I did not see the note.

Best,

Duy Le
UCF

On Thu, Apr 19, 2018 at 1:38 PM, Kevin May <kmay at mit.edu> wrote:

> Hi,
>
> In the release notes for 6.2 it says:
>
> * Some constants in the definition of PBE functionals were truncated to
>     6 significant digits. While not a bug, this could lead to tiny differences
>     with respect to previous results and other XC implementations (r13592)
>
>
> I would guess this explains it.
>
> Best
>
> Kevin May
> PhD Candidate
> Department of Mechanical Engineering
> MIT
>
>
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