XML Root tag closing in BSE and TDDFT

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XML Root tag closing in BSE and TDDFT

#1 Post by Malediction » Fri Jul 12, 2019 8:54 am

I've noticed that when using the GW-BSE and the TDDFT routines the root tag (<modeling>) is not closed in the vasprun.xml file, and thus it's problematic to parse. It's closed for other processes so I assume this was unintentional? I've attached a Si BSE calculation I did for an example, with the vasprun included.
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