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[ESPResSo-users] H5MD file in espressomd


From: Jiaxing Yuan
Subject: [ESPResSo-users] H5MD file in espressomd
Date: Tue, 9 Apr 2019 15:58:07 +0800

Dear all,

I am considering writing system configuration into the H5MD file. I use the following command lines as explained in the document:
from espressomd.io.writer import h5md
........#system setup 
h5 = h5md.H5md(filename="trajectory.h5", write_pos=True, write_vel=True)
for i in range(100000):
    system.integrator.run(200) 
    h5.write()

However, I encounter the following error:

ValueError: Class 'ScriptInterface::Writer::H5mdScript' not found.


I wonder if this is because my command lines are wrong or due to the missing modules in my compiled espressomd?


Best,

Jiaxing 



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