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New inpgen features in MaX6.1 #197

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janssenhenning opened this issue Sep 23, 2022 · 0 comments · Fixed by #213
Closed
2 tasks

New inpgen features in MaX6.1 #197

janssenhenning opened this issue Sep 23, 2022 · 0 comments · Fixed by #213
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enhancement New feature or request parser/fleur Issues related to the file parsers for fleur

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@janssenhenning
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  • New scf namelist allowed
  • Magnetic moment definitions can now be made after atom positions

Open question:
Should there be some way of forbidding new features with a given inpgen version argument
@janssenhenning janssenhenning added enhancement New feature or request parser/fleur Issues related to the file parsers for fleur labels Sep 23, 2022
@janssenhenning janssenhenning mentioned this issue Dec 2, 2022
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enhancement New feature or request parser/fleur Issues related to the file parsers for fleur
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Support magnetic moment definitions in inpgen IO JuDFTteam/masci-tools
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@janssenhenning