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remove duplicated code
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Signed-off-by: Han Wang <[email protected]>
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wanghan-iapcm authored Sep 20, 2024
1 parent d7ec22f commit 49116ca
Showing 1 changed file with 0 additions and 13 deletions.
13 changes: 0 additions & 13 deletions dpdata/qe/scf.py
Original file line number Diff line number Diff line change
Expand Up @@ -15,19 +15,6 @@
length_convert as bohr2ang,
)

_QE_BLOCK_KEYWORDS = [
"ATOMIC_SPECIES",
"ATOMIC_POSITIONS",
"K_POINTS",
"ADDITIONAL_K_POINTS",
"CELL_PARAMETERS",
"CONSTRAINTS",
"OCCUPATIONS",
"ATOMIC_VELOCITIES",
"ATOMIC_FORCES",
"SOLVENTS",
"HUBBARD",
]

_QE_BLOCK_KEYWORDS = [
"ATOMIC_SPECIES",
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