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Re: [h5md-user] thermodynamics module

From: Peter Colberg
Subject: Re: [h5md-user] thermodynamics module
Date: Fri, 11 Oct 2013 10:33:54 -0400
User-agent: Mutt/1.5.21 (2010-09-15)

Hi Felix,

On Fri, Oct 11, 2013 at 11:16:06AM +0200, Felix Höfling wrote:
> Peter, thanks for creating the thermodynamics module! A few
> amendments and remarks from my side:

Yes, please make any changes and refinements as you see fit. My text
was only a very rough draft to get started.

> Further, 'dimension' is not really an H5MD 'element' as it does not
> change in time, it carries no unit etc. It could become an attribute
> as it is for the box.

As a suggestion, I made this one a (time-independent) dataset, since
it did not really fit well anywhere as an attribute. For efficiency it
can be stored as a compact dataset.


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