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Localised orbitals of an open-shell molecule: alpha and beta folded into one list #575

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@ohlincha

9.4.0 test (Andy): for a paramagnetic species the Localised orbitals panel lists alpha and beta separately. Wanted: one list in which an alpha and a beta localised orbital that describe the same bond or lone pair (overlap near 1) show as one row with occupation 2, and the unpaired ones as occupation 1 rows (alpha), so the table reads like the closed-shell one. Options and a mock-up before the fix.

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  1. self-assigned this
    on Oct 26, 2026
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