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Re: [h5md-user] thermodynamics module
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From: |
Peter Colberg |
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Subject: |
Re: [h5md-user] thermodynamics module |
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Date: |
Fri, 11 Oct 2013 10:33:54 -0400 |
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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.
Peter