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  • H20 MM Uff SP1

    Uploaded by

    Nisa Khoirunnisa
    8 views1 page
    Komputasi

    Original Title

    H20-MM-UFF-SP1

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    Komputasi

    Copyright:

    © All Rights Reserved
    Download as TXT, PDF, TXT or read online from Scribd
    Flag for inappropriate content
    8 views1 page

    H20 MM Uff SP1

    Uploaded by

    Nisa Khoirunnisa
    Komputasi

    Copyright:

    © All Rights Reserved
    Download as TXT, PDF, TXT or read online from Scribd
    Flag for inappropriate content
    of 1

    Filename = C:\G09W\Scratch\GQL_410a\t_5y9.

    chk

    Title Card Required


    File Name = t_5y9
    File Type = .chk
    Calculation Type = SP
    Calculation Method = RHF
    Basis Set = 3-21G
    Charge = 0
    Spin = Singlet
    Total Energy = -75.07038343 a.u.
    RMS Gradient Norm = 0.00000000 a.u.
    Imaginary Freq =
    Dipole Moment = 1.2185 Debye
    Point Group =

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