Notes
Slide Show
Outline
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SmallOscillations
  • Normal Mode analysis of Lagrange equations for systems undergoing small oscillations about equilibrium
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Linear symmetrical triatomic molecule
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Generalized coordinates
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Potential energy: harmonic approximation
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Matrix V:  potential energy
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Kinetic energy T and its corresponding matrix T
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Equation for eigenvalues
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Evaluation of determinant equation
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Eigenvalue equation
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Normal mode frequencies
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Physical interpretation of frequencies
  • The zero frequency corresponds to a rigid translation of the molecule along its axis.  There is no change in potential energy and the restoring force against this translation is zero.  There are actually only two degrees of freedom; one of the three we started with is a rigid body degree of freedom
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Physical interpretation …
  • The second solution is the solution for a mass m undergoing oscillations with a spring of force constant k.  Therefore we should find later that only the end atoms participate in this mode of oscillation.  The center atom remains fixed.
  • The mass M only oscillates in the third normal mode solution.



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Modes of oscillation
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“Eigenvectors”
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Recall structure of V, T
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Equations for eigenvectors
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Normalization condition
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"Zero frequency solution:"
  • Zero frequency solution:  first and third equations then require that all three coefficients are equal


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Second mode
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Second mode (from normalization)
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Third mode
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Normal modes
  • The general solution of equations of motion are
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Initial conditions
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Matrix form of initial conditions
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Matrix form of initial conditions (continued)
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Normal coordinates
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Potential energy in normal coordinates
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Kinetic energy in normal coordinates
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Lagrange equations in normal coordinates
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Forced undamped oscillator
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General Solution of equation of motion
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Particular solution for periodic force
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General solution oscillates at two frequencies: natural and forcing frequencies
  • The constants A and delta  in the natural oscillation depend on the initial conditions. The oscillation associated with the periodic force depends on the driving frequency and amplitude of the force.
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Forcing frequency equals natural frequency of oscillation
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General solution when forcing frequency equals natural frequency
  • In this case the inhomogeneous term eventually overwhelms the homogeneous term.  This is unphysical; every real system has some damping.  Without damping the system has no way to dissipate the energy given it by F(t)
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Forced damped oscillator
  • If one adds a dissipation function to the
  • Lagrangian (as before), then one obtains a equation for the damped, forced oscillator


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General solution of damped, forced oscillator
  • Choose coefficients beta and omega real;
  • Alpha and Gamma are complex (phase differences) .  Take real part of solution
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Natural frequency of damped harmonic oscillator
  • It is easy to show that the homogeneous solution is a solution of the damped harmonic oscillator, if



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Particular solution of damped harmonic oscillator
  • Try complex solution: take real part later
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Particular solution
  • Assume force is also of complex form:
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Steady state response amplitude
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AC Circuit Analogue
  • In AC electrical circuits, the driving force is the applied voltage, V(t), and the response of interest is the current


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Steady state current
  • The homogeneous solution decays to zero due to the damping factor in the exponential.  Thus the steady state value of the “current” comes from the time derivative of the particular solution.  So


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Steady state response amplitude
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Steady state rate of dissipation of energy
  • In the steady state, energy is dissipated at the rate it is fed in by the driving force.
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Time average
  • There are two terms in the rate of dissipation that both average to zero, as they are out of phase with each other (and hence are as often positive as negative in one period).  These are


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Intensity
  • So all that survives in the time average is
  • the contribution from the damping term:
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Intensity (continued)
  • Thus the explicit form of the intensity is
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Maximum intensity
  • The maximum value of the intensity occurs when Omega equals the natural frequency of the undamped, unforced oscillator
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Square amplitude of response of damped harmonic oscillator:
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Response of damped harmonic oscillator: Intensity
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Chain of N coupled harmonic oscillators
  • The potential energy V is
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Periodic boundary conditions
(atoms on a ring)
  • If go around chain of atoms once, the
  • N+1 atom is the same as atom 1, etc


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Try plane wave solution (and take real part)
  • Let x(t) be the real part of the following form:
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PBC requires discrete values of wavenumber k
  • From PBC
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Is plane wave a solution of Lagrange equations?
  • Substitute the plane wave into the equation of motion for x:
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Dispersion relation
  • This plane wave is a solution if and only if the frequency depends on k as
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Actual displacements
  • The actual solutions are the real or imaginary parts of the plane wave:  Thus


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Dispersion relation: first Brillouin zone
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Group velocity: velocity with which the energy of wave packet travels
  • If general displacement of atoms is made up of superposition of these waves, the energy travels at group velocity