JDFTx  1.4.2
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band-unfold

Syntax:

band-unfold  \
    <M00> <M01> <M02> \
    <M10> <M11> <M12> \
    <M20> <M21> <M22>

Description:

Unfold band structure from a supercell calculation to a unit cell with lattice vectors Runit, defined by the integer matrix M such that current lattice vectors R = Runit * M.

Properties:

Requires:     (None)

Forbids:     (None)

Allow multiple:    no

Default:     (None)

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