Re: [ESPResSo-devel] Nsquare cellsystem and folded positions

[Olaf Lenz]

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Kai Grass wrote:
> And, I think, the answer is, it should print the correctly folded
> positions. A behaviour of a top-level command that is depending on which
> underlying cell system you are using is highly undesirable.

As long as it is documented, it is OK to have a way to get the internal
coordinates. However, I also think that it would be desirable to have a
command that returns the correctly folded coordinates, which would
probably be what one expects with "folded_pos"!

The main problem remains: Periodic boundary conditions simply do not
work in the nsquare cell system.

Olaf
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