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[WIP] Nexus Wannier90 Interface #5385

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[WIP] Nexus Wannier90 Interface #5385

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1f1dcb7
wannier90 input tested
kayahans Mar 7, 2025
a0f3418
version wannier90 and add pw2wannier90
kayahans Mar 7, 2025
1cc6540
pw2wan90 input tests are added
kayahans Mar 7, 2025
2ef26d0
wan90 handles unit change
kayahans Mar 7, 2025
10ed010
prefix not needed in wannier90
kayahans Mar 7, 2025
c4a5c74
prefix not needed in wannier90
kayahans Mar 7, 2025
46bb395
Update wannier90_input.py
kayahans Mar 7, 2025
22ad6af
Merge branch 'wannier' of https://github.com/kayahans/qmcpack into wa…
kayahans Mar 7, 2025
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prefix not needed in wannier90
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@kayahans
kayahans committed Mar 7, 2025
commit 10ed010485ebc18d53dbc1cf7f0727e76f83a0ef
1 change: 0 additions & 1 deletion nexus/lib/wannier90_input.py
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Original file line number Diff line number Diff line change
Expand Up @@ -358,7 +358,6 @@ def format_projections(projections):


def generate_wannier90_input(
prefix = 'wannier',
system = None,
num_wann = None,
num_bands = None,
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