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[h5md-commit] [SCM] UNNAMED PROJECT branch, master, updated. dd4faedca24
From: |
Felix Höfling |
Subject: |
[h5md-commit] [SCM] UNNAMED PROJECT branch, master, updated. dd4faedca244b94e2bec2c5c6162f534f85da064 |
Date: |
Mon, 06 May 2013 15:08:19 +0000 |
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commit dd4faedca244b94e2bec2c5c6162f534f85da064
Author: Felix Höfling <address@hidden>
Date: Mon May 6 17:05:16 2013 +0200
Revise description of observables group
* clean up introductory paragraph
* add count attribute as discussed in
http://lists.nongnu.org/archive/html/h5md-user/2013-02/msg00001.html
* allow for observables of higher tensor rank, e.g., the stress tensor
* add note what "temperature" actually means. The true thermodynamic
temperature is only defined as ensemble average and does not fluctuate
in NVT simulations (the kinetic energy does).
commit 8e0f25f657d5221ca47c9b2681725d4d79e8dde3
Author: Felix Höfling <address@hidden>
Date: Mon May 6 17:03:08 2013 +0200
revise text for tajectory group
* revise introducory paragraph, add general definition of what is meant
by "trajectory" information
* add semi-grandcanonical Monte-Carlo as example for fluctuating species
-----------------------------------------------------------------------
Summary of changes:
draft.rst | 88 ++++++++++++++++++++++++++++++++++--------------------------
1 files changed, 50 insertions(+), 38 deletions(-)
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Felix Höfling <=