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Parser for xml format 2nd order force constants #90

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nakib opened this issue Apr 5, 2023 · 0 comments
Open

Parser for xml format 2nd order force constants #90

nakib opened this issue Apr 5, 2023 · 0 comments
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enhancement New feature or request good first issue Good for newcomers help wanted Extra attention is needed

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@nakib
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nakib commented Apr 5, 2023

SOC enabled EPW calculations require the second order force constants in the xml format. Thinking about writing an xml parser, or use an external library to do this, in elphbolt.
@nakib nakib added enhancement New feature or request help wanted Extra attention is needed good first issue Good for newcomers labels Apr 5, 2023
@nakib nakib moved this to To do in elphbolt Kanban Jul 3, 2024
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enhancement New feature or request good first issue Good for newcomers help wanted Extra attention is needed
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