quantum transport :atom to transistor,phonons, emission & absorption

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    Quantum Transport:Quantum Transport:Atom to Transistor

    P rof. Supriyo DattaECE 659Purdue University

    Network for Computational Nanotechnology

    04.23.2003

    Lecture 37: Phonons, emission & AbsorptionRef. Chapter 10.2 & 10.4

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    Interband transitions are a lotlike atomic transitions

    Intraband transitions,otherwise known as Cerenkovradiation, can occur with bothphonons and photons

    Intraband transitions couldtake picoseconds whereasinterband transitions usuallytake nanoseconds

    In the first part of this lecture we discussintraband transitions. Up till now we havecovered only interband transitions

    E

    k v

    intraband

    interband

    Transitions

    Introduction00:00

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    However, silicon interbandtransitions take as long as amillisecond

    From the diagram on the left one can seethat for emission,

    and absorption

    where the photon wave vector requiredis very large. Since is often very smallfor light the coupling between non-verticaltransitions is weak and hence is large

    Note: vertical transitions are notpermitted in silicon because there is notany empty state available in the valenceband if the electron is to drop vertically.

    Interband Silicon Transitions

    E

    k v

    interband transition

    vvv

    = k k f

    vvv

    += k k f

    v

    v

    Silicon InterbandTransitions

    00:50

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    Just as with interband transitions, intraband transition lifetimes are defined as:Emission

    Absorption

    Importantly, for intraband transitions the final state retains the initial state wavefunction. Therefore, and for emission we requirelikewise for absorption

    ( ) ( )[ ] +== vv

    vh

    vvvh

    )()()(212

    k k K N

    ( ) ( )[ ] ++==

    vv

    vh

    vvvh )()()(2

    2k k K N

    vvv

    = k k f ( ( 0=+

    vh

    vvvwk k

    ( ) 0cos22222

    22

    2

    =+ ck k m

    k m

    hhh

    k mk cm

    k mc

    22

    cos 2

    2

    +=

    +

    = hh

    hh)()(

    rvrv k k

    ) ) ) = 0 vhvvv

    wk k

    0= v

    hvvv

    wk k

    Intraband Formalism05:30

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    So, we need to have a phonon or photon with direction and an electronwith direction

    Note: for phonons c s is usuallyused in place of (Velocity of sound instead of velocity of light)

    The term cos gives theCerenkov cone for phonons/photons, this effect is exactly the

    same as the sonic boom producedby jets

    We can work out the same resultfor absorption, only a sign changeresults Inspecting the equality

    we see that since cos 1 emission isonly possible if the electron velocity,k/m, exceeds the photon/phononvelocity

    v

    k v

    v

    k v

    k mk c

    2cos += h

    c

    c

    Coupling13:28

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    Similar to a classical harmonicosscilator this mass-spring system hasa resonant frequency defined by

    with discrete energies. We definephonons as the quantized energy

    exchanged between vibrating masses

    Next : An introduction to phononsand their dispersion curves

    Basic Definition : phonons are thelattice vibrations (sound) whichpropagate through a solid or molecule

    For example, hydrogen moleculesvibrate about an equilibrium bonddistance, R eq , with an intensityproportional to temperature muchlike a spring mass system

    H2 Harmonic Oscillator

    H H

    m m

    Req

    M K =

    Phonons20:52

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    Now, assuming sine or cosinesolutions to the equation we can write

    or

    The above translates easily into matrixform:

    We can make a similar extensionto the infinite 1-D lattice producing amass-spring structure of the form

    where m is the mass of each atomand U m(t) is the displacement of them th atom from equilibrium its

    equilibrium position. Thus, according to Newtons lawthe force exerted on the m th atom is

    Um-1 (t)

    a

    Um(t) Um+1 (t)

    ( ) ( )1122

    + = mmmmm U U K U U K dt U d m

    ( ) mm U dt t U d 2

    2

    2

    =

    ( )112 2 + += mmmm U U U m K U

    =

    MO

    OO

    M

    3

    2

    1

    3

    2

    1

    2

    1

    1

    121112

    U

    U U

    m K

    U

    U U

    1-Dimensional Lattice23:00

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    This gives rise to a dispersion relation whichlooks like

    Likewise, takingadvantage of matrixperiodicity, for phonon wemay use the ansatz

    such that

    v

    aim eU U

    =0

    ( )

    ( )

    =

    =

    =

    2sin2

    2sin22

    cos12

    2

    2

    amk

    amk

    amk

    v

    - /a /a

    and around the origin the curve is oftenapproximated linearly by the relation

    amk =

    1-D Dispersion Relation28:37

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    Acousticand OpticalBranches

    Acoustic phonons propagate in onedirection

    Optical phonons squeeze or pushtwo atoms together

    In semiconductors another phonon vs. branch often occurs,otherwise known as optical phonons.This results when two types of atoms,and hence two different masses,exist in a unit cell. For example,GaAs:

    In the dispersion relation we denotethe upper branch optical branch(has nothing to do with light) and thelower branch acoustic branch. Thereason we call the upper one opticalis because if you shine light on thesolid you can excite this branch.

    Ga As Ga As

    v

    - /a - /a

    GaAsGa acoustic phonon

    AsGaoptical phonon

    Optical Phonons32:40

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    The electric field, , of a photon is uniform on an atomic scaleand induces opposite force on the +ve and -ve bonding pair

    Physical intuition on the flatness of the upper branch & strongdependence of lower branch on

    Lets ask ourselves why does the frequency generally go up with ? Frequency goes up asthe spring gets stiffer is a certain deformation is caused. is like the wavelength. When youhave a 1-D series of atoms and you excite the first one, if the wavelength is relatively large,the first atom moves a lot, the second moves by almost the same amount, the third movesalmost the same and so on. So the spring itself is not distorted a lot. However , for shorter

    wavelengths the displacement in the atom 1 and atom 2 is considerably different such thatthe spring feels a lot stiffer and so for short wavelengths the frequency goes up. This does

    not happen for the optical branch. It doesnt matter if the wavelength is lone or short. Within aunit cell, the two atoms move opposite to each other and thats what determines the stiffness(they are moving against each other, its very stiff anyway). For short or long wavelength the

    spring is distorted. So - curve for the optical branch tends to be relatively flat.

    The final coupling constant for any phonon as found in is a product of the phonon strain andthe induced deformation potential. The deformation potential is the actual shift in theconduction band of a solid due to the passage of a phonon. It is derived experimentally

    v

    AsGa

    +ve -ve E v

    Closing Comments38:00