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    #1 2024-06-22 16:28:42

    str
    Member
    Registered: 2024-06-22
    Posts: 1

    QTAIM: paths between (3,-1) and (3,+1)

    Dear Tian,

    First of all, thanks for all your work. Multiwfn is a life-saver and I've used your manual multiple times for a quick crash-course through quite a few subjects.

    My question concerns QTAIM paths. Multiwfn can generate a path between (3,-3) and (3,-1) CPs and (3,+1) and (3,+3) CPs, yet there's no paths between (3,-1) and (3,+1). Is there an easy way to generate those through the software (a hidden option perhaps?).

    Thank you!

    Last edited by str (2024-06-22 17:10:57)

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    #2 2024-06-22 22:49:29

    sobereva
    Tian Lu (Multiwfn developer)
    From: Beijing
    Registered: 2017-09-11
    Posts: 2,011
    Website

    Re: QTAIM: paths between (3,-1) and (3,+1)

    Sorry, currently Multiwfn doesn't support generating this kind of topology path.

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