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    Home > Chemicals Industry > Chemical Technology > Radial probability distribution plot

    Radial probability distribution plot

    • Last Update: 2021-06-18
    • Source: Internet
    • Author: User
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    In a two-dimensional rectangular coordinate system, the image of a single variable function can be drawn, and what is obtained is a curve; in a three-dimensional rectangular coordinate system, the image of a function of two variables can be drawn, and the obtained surface is a curved surface
    .

    In the three-dimensional rectangular coordinate system, the image of the wave function Ψ(x, y, z) with three variables cannot be drawn
    .


    In the spherical coordinate system, the wave function is expressed as Ψ(r,θ,Φ)=R(r)Y(θ,Φ), and its image cannot be drawn in three-dimensional space


    1.
    Radial probability distribution plot

    From Figure 5-4, we can understand the changing trend of |Ψ| 2 -r
    .


    For 1s electrons, the probability density |Ψ| 2 decreases as r increases


    If we consider the variation of the probability of electrons in a thin-layer spherical shell per unit thickness with r, the probability that the thickness of the thin-layer spherical shell at the distance r from the core is △r can be found (Figure 5-6)
    .



    Figure 5-6 Image of 1s electron

    (a)|R| 2 changes with r; (b) electron cloud: (c) spherical shells of unit thickness with unequal radii

    The area of ​​the sphere at the distance r from the core is 4πr 2 , and the volume of the thin spherical shell is approximately 4πr 2 △r
    .


    Considering only the change of |Ψ| 2 with r, the radial probability density |R| 2 can be used instead of |Ψ| 2


    w=4πr 2 △r|R| 2

    The probability of electrons appearing in unit spherical shell thickness is

    D(r) is called the radial distribution function, which represents the probability of electrons appearing in a spherical shell of unit thickness from the core r
    .


    By plotting D(r) against r, the radial probability distribution diagrams of electrons in various states can be obtained (Figure 5-7)


    According to the radial probability distribution diagram, 1s has 1 probability peak, 2s has 2 probability peaks.


    .
    .


    Figure 5-7 Radial probability distribution diagram

    There is a nodal plane with a probability density of 0 between the two peaks, and the number of nodal planes with a probability density of 0 for each state of electron movement is

    N section surface = nl-1

     

     

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