Átomo de Hidrógeno 1

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    SS 06 - 20 102: Introduction to atomic and molecular physics Lecture 1: Basic concepts about atoms and quantum physics

    The Schrdinger equation in spherical coordinates.

    For most realistic potentials, the Schrdinger equation in Cartesian coordinates is not soluble by using theseparation of the wave function in three independent wave functions. For example, for the electromagneticinteraction between an electron and a proton, the potential is:

    Transformation to a spherical coordinate system.

    )r(Vr

    ke

    zyx

    ke)z,y,x(V

    2

    222

    2

    ==

    ++

    =

    The Schrdinger equation is then:

    Now, the new equation in sphericalcoordinates is separable.

    A set of three new quantum numbersappears. But now, the quantumnumbers are not fully independent oneanother.

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    SS 06 - 20 102: Introduction to atomic and molecular physics Lecture 1: Basic concepts about atoms and quantum physics

    Separation of variables

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    SS 06 - 20 102: Introduction to atomic and molecular physics Lecture 1: Basic concepts about atoms and quantum physics

    Separation of variables

    1. The Schrdinger equation for the hydrogen atom involves Coulomb potential ke2

    /r. Since this is a centralpotential (it has spherical symmetry) the equation can be separated in different independent equationswhen it is expressed in spherical coordinates.

    RADIALRADIAL

    ANGULARANGULAR

    RADIALRADIAL == --LL22 ANGULARANGULAR == --LL

    22

    0

    d

    )(dPsin

    d

    d

    )(P

    sinsin

    L

    d

    )F(d

    )F(

    1 22

    2

    2

    2

    =

    +

    h

    )(F)(P)r(R),,r( =

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    SS 06 - 20 102: Introduction to atomic and molecular physics Lecture 1: Basic concepts about atoms and quantum physics

    Separation of variables: Solution of angular components

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    SS 06 - 20 102: Introduction to atomic and molecular physics Lecture 1: Basic concepts about atoms and quantum physics

    Solution of the angular part of the Schrdinger equation.

    2. The solution of every independent equation gives rise to a different quantum number.

    0d

    )(dPsin

    d

    d

    )(P

    sinsin

    Lm

    2

    2

    22

    l =

    +

    h

    Cd

    )F(d

    )F(

    12

    2

    =

    cAe)F( =

    General solutionGeneral solution

    )2F()F( +=

    Azimuth boundary conditionAzimuth boundary condition

    ++

    2

    l

    l

    im

    mc

    egerintm

    Ae)F( l

    =

    =

    =

    Azimuth solutionAzimuth solution

    General solutionGeneral solution

    This equation has asolution, only when:

    The solution are

    Legendre polynomial

    l

    2

    l2

    2

    2

    2

    ml;0mL

    )1l(lL

    >

    +=

    h

    h

    cosx

    )x(P l

    ml

    =

    iml

    mlm,l e)(cosP)(F)(P),(Y

    l== lm

    l

    l