be phys 2010 11 quantum mechanics
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QUANTUM MECHANICS
1BE-PHYSICS-QUANTUM MECHANICS-2010-11MIT- MANIPAL
TOPICS
Text BookPHYSICS for Scientists and Engineerswith Modern Physics (6th ed)
By Serway & Jewett
An Interpretation of Quantum Mechanics
One- Dimensional Wave Functions & ExpectationValues
The Particle Under Boundary Conditions
The Schrodinger Equation
The particle in a BOX A particle in a Well of finite Height
Tunneling Through a Potential Energy Barrier
The Scanning Tunneling Microscope
The Simple Harmonic Oscillator
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Quantum Mechanics
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Quantum Mechanics
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Quantum Mechanics deals with WaveNature ofmicroscopic particles
It enables us to understand many
phenomena involving atoms, molecules,
nuclei, and solids
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Making a conceptual connection between particles and
waves.
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For an electromagnetic radiation, we have the probabilityper unit volume of finding a photon in a given region ofspace at an instant of time as
Electromagnetic Wave Photon
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Taking the analogy between electromagnetic radiation andmatter we can say
Theprobabilityper unit volume of finding theparticle
is proportional to the square of the amplitude of
the wave representing theparticle
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The amplitude of the de Broglie wave associated
with a particle is calledprobability amplitude, or the
wave function, and is denoted by.6BE-PHYSICS-QUANTUM MECHANICS-2010-11MIT- MANIPAL
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A wave function
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In general, the complete wave function for a system
depends on thepositionsof all the particles in the system
and on timeand can be written as
(rj,t) = (rj) eitwhere rj is the position vector of the j
TH particle in the
system.
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can be real or complex. But ||2 is always real and positive, and is proportional
to the probability per unit volume, of finding the particle
at a given point at some instant.
Ifrepresents a single particle, then ||2 (called theprobability density) is the relative probability per unit
volume that the particle will be found at any given point
in the volume.
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The total probability of a particlebeing in the interval a x b is thearea under the probability densitycurve from a to b.
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One-Dimensional Wave Functions
P(x) dx = ||2 dx is theprobability to find the particle inthe infinitesimal interval dxaround the point x
dxP2
b
a
ab
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Normalization
Because the particle must besomewhere along the x axis, the sum ofthe probabilities over all values of x(from
to
) must be 1.
1dx
-
2
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Forcing this condition on the wave
function is called normalization
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Expectation Value
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The average position at which one
expects to find the particle after many
measurements is called theexpectation valueof xand is
defined by the equation
dxxx
where * is the complex conjugate of
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Expectation Value
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The expectation value of any function
f(x) associated with the particle is
dx)x(f)x(f
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The important mathematical features of a physically reasonablewave function (x) for a system are
(i) (x), must be finite, continuous and single valued everywhere;
(ii) The space derivatives of, must be finite, continuous andsingle valued every where;
(iv) must be normalizable.
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SJ: P-SE 41.1 A wave Function for a particle
A particle wave function is given by the equation (x) = A eax2(A) What is the value of A if this wave function is normalized?
(B) What is the expectation value of x for this particle?
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1dx
-
2
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SJ: Section 41.1 P -1 A free electron has a
wave function where x is
in meters. Find (a) its de Broglie
wavelength, (b) its momentum, and (c) its
kinetic energy in electron volts.
)x100.5(i 10eA)x(
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The Schrdinger Wave Equation
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The Schrdinger Equation
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Just like the electromagnetic waves,the waves associated with materialparticles also satisfy a waveequation.
The wave equation for material
particles is different from thatassociated with photons becausematerial particles have a nonzerorestenergy.
The appropriate wave equation formatter waves was developed byErwin Schrdinger.
Erwin Schrdinger
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THE SCHRDINGER EQUATION
Schrdinger equation as it applies to a particle of mass mconfined to moving along x axis and interacting with its
environment through a potential energy function U(x) is
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Where E is a constant equal to the total energy ofthe system (the particle and its environment).
= h/2
+
The above equation is referred to as the one-dimensional,time-independent Schrdinger equation.
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Application of Schrdinger equation.
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PARTICLE IN A BOX OR INFINITE SQUARE WELL
In figure (a), a particle ofmass mand velocity v, confined to
bouncing between two impenetrable walls separated by a distance
L is shown. Figure (b) shows the potential energy function for the
same system.
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PARTICLE IN A BOX OR INFINITE SQUARE WELL
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Because the walls are impenetrable, there is zeroprobability of finding the particle outside the box
Therefore,
() < >
() must be continuous in space. There must be nodiscontinuous jumps in the value of the wave function atany point. Therefore, if is zero outside the walls, it must
also be zero atthe wallsTherefore, ( )
Boundary Conditions on the wave function.
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PARTICLE IN A BOX OR INFINITE SQUARE WELL
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As long as the particle is inside the box, the potential energyof the system does not depend on the location of the particleand we can choose its constant value to be zero
Hence < < Outside the box, we must ensure that the wave function is
zero. We can do so by defining the systems potential energyas infinitely large if the particle were outside the box.
The only way a particle could be outside the box is if the systemhas an infinite amount of energy, which is impossible
Boundary Conditions on the potential energy.
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Only those wave functions that satisfy these boundary
conditions are allowed.In the region 0 < x < L, where U = 0, the Schrdingerequation takes the form
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PARTICLE IN A BOX OR INFINITE SQUARE WELL
+
< >
( )
< <
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The most general form of the solution to the above equation is () + ()
where A and B are constants determined by the boundary andnormalization conditions.
Applying the first boundary conditions,
i.e., at , leads to()+() ,and at , , () + () + ,
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PARTICLE IN A BOX OR INFINITE SQUARE WELL
,
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since A 0 , sin(kL) = 0 .
; ( 1, 2, 3, . . )
Each value of the integer n corresponds to a quantizedenergy value, En, where
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PARTICLE IN A BOX OR INFINITE SQUARE WELL
,
,,
C O O SQ
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Energy level diagram for a particle
confined to a one-dimensional boxof length L. The lowest allowedenergy is
E1 = h2/8mL2.
According to quantummechanics, the particle can
never be at rest !!!.
This is the ground state energy for the particle in a box. Excited statescorresponds to n = 2, 3, 4 ---- have energies given by 4E1 , 9E1 , 16E1 ---.
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PARTICLE IN A BOX OR INFINITE SQUARE WELL
,
PARTICLE IN A BOX OR INFINITE SQUARE WELL
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To find the constant A, apply normalization condition
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The corresponding wavefunctions are
PARTICLE IN A BOX OR INFINITE SQUARE WELL
( + )
, ,
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Fig. (a) The wave functions for n=1, 2, and 3.Fig. (b) The probability densities for n=1, 2, and 3.
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PARTICLE IN A BOX OR INFINITE SQUARE WELL
The first three allowed states for a particle confined to a one-dimensional box are shown next.
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PARTICLE IN A BOX
SJ: Section 41.2 P- 10
A proton is confined to move in a one-dimensional box of
length 0.20 nm. (a) Find the lowest possible energy of the
proton. (b) What is the lowest possible energy for an electron
confined to the same box? (c) Account for the great difference
in results for (a) and (b)
Mass of proton: 1.67 X 10-27kg
Mass of electron: 9.11 X 10-31 kg
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PARTICLE IN A BOX
See the sample problems P-SE 41.2, 41.3 and 41.4
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A particle in a well of finite height
A PARTICLE IN A WELL OF FINITE HEIGHT
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A PARTICLE IN A WELL OF FINITE HEIGHT
Potential energy diagram of a
well offinite height U and
length L. A particle is trapped in
the well. The total energy E of
the particle-well system is lessthan U
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, < < , < >
A PARTICLE IN A WELL OF FINITE HEIGHT
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The Particle energy E < U ;
Classically the particle is permanently bound in the potentialwell and cannot come out.
However, according to quantum mechanics, a finite probabilityexists that the particle can be found outside the well even if the
total energy E < U.
That is, the wave function is generally nonzero in regions I andIII. This is possible due to the uncertainty principle.
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A PARTICLE IN A WELL OF FINITE HEIGHT
A PARTICLE IN A WELL OF FINITE HEIGHT
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The Schrdinger equation outside the finite well in regions I and III is:
General solution of the above equation is
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A PARTICLE IN A WELL OF FINITE HEIGHT
()
+
A PARTICLE IN A WELL OF FINITE HEIGHT
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Solutionshould be finite.A must be 0 in Region III and B must be zero in Region I,otherwise, the probabilities would be infinite in those
regions.
Therefore, the wave functions outside the finite potentialwell are
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A PARTICLE IN A WELL OF FINITE HEIGHT
< >
Thus the wave function outside the potential well decay
exponentially with distance.
A PARTICLE IN A WELL OF FINITE HEIGHT
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Schrodinger equation inside the square well potential inregion II, where U = 0 is
General solution of the above equation is
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A PARTICLE IN A WELL OF FINITE HEIGHT
() + ()
A PARTICLE IN A WELL OF FINITE HEIGHT
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To determine the constants A, B, F, G, & the allowed valuesof energy E, we can apply the four boundary conditions and
the normalization condition.
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A PARTICLE IN A WELL OF FINITE HEIGHT
() ()
=
= &
=
=
But the boundary conditions nolonger require that the wavefunction must be zero at the ends of the well
A PARTICLE IN A WELL OF FINITE HEIGHT
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0x0x dxdx
d
)0()0(
III
III
d
LxLx dx
d
dx
d
)L()L(
IIIII
IIIII
Boundary conditions Boundary conditions
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A PARTICLE IN A WELL OF FINITE HEIGHT
A PARTICLE IN A WELL OF FINITE HEIGHT
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A PARTICLE IN A WELL OF FINITE HEIGHT
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Tunneling through a Potential Energy Barrier
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li h h i l i
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Consider a particle of energy E approaching a potential barrier
of height U, (E < U). Potential energy has a constant value of U
in the region of width L and is zero in all other regions. This is
called a square barrier and U is called the barrier height.
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Tunneling through a Potential Energy Barrier
Tunneling through a Potential Energy Barrier
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Since E < U, classically the regions II and III shown in the figure are
forbidden to the particle incident from left. But according toquantum mechanics, all regions are accessible to the particle,regardless of its energy. The particle can violate classical physics by for a short time, ~ / .
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u e g t oug a ote t a e gy a e
Tunneling through a Potential Energy Barrier
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The wave function is sinusoidal in regions I and III but exponentiallydecaying in region II.The probability of locating the particle beyond
the barrier in region III is nonzero. The movement of the particle to
the far side of the barrier is called tunneling or barrier penetration.
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Tunneling through a Potential Energy Barrier
Tunneling through a Potential Energy Barrier
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The probability of tunneling can be described with atransmission coefficient T and a reflection coefficient R.
The transmission coefficient represents the probability that theparticle penetrates to the other side of the barrier, andreflection coefficient is the probability that the particle isreflected by the barrier.
Because the particles must be either reflected or transmittedwe have, R + T = 1.
An approximate expression for the transmission coefficient,when T
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Applications of Tunneling Phenomenon
THE SCANNING TUNNELING MICROSCOPE
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THE SCANNING TUNNELING MICROSCOPE
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The scanning tunneling microscope (STM)enables scientists to obtain highly detailed
images of surfaces at resolutions comparable to
the size of a single atom.
An electrically conducting probe with a very sharp
tip is brought near the surface to be studied.
The empty space between tip and surface
represents the barrier, and the tip and surfaceare the two walls of the potential well.
Because electrons obey quantum rules ratherthan Newtonian rules, they can tunnel across
the barrier of empty space. If a voltage is appliedbetween surface and tip, electrons in the atoms of
the surface material can tunnel preferentially from
surface to tip to produce a tunneling current. In this way, the tip samples the distribution of
electrons immediately above the surface
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SJ: P-SE 41.6 A 30-eV electron is incident on a square barrier ofheight 40 eV. What is the probability that the electron will tunnel
through the barrier if its width is (A) 1.0 nm? (B) 0.10 nm?
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Tunneling through a Potential Energy Barrier
Tunneling through a Potential Energy Barrier
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SJ: Section 41.6 P- 27
An electron with kinetic energy E =
5.0 eV is incident on a barrier with
thickness L = 0.20 nm and height U =
10.0 eV as shown in the figure.
What is the probability that the electron (a) will tunnel through the
barrier? (b) will be reflected?
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g g gy
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The Simple Harmonic Oscillator...
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THE SIMPLE HARMONIC OSCILLATOR
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The oscillatory motion of an object is said to be simpleharmonic, if the force acting on it is proportional to itsdisplacement from an equilibrium position and is actingin a direction opposite to the displacement of theobject
,
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THE SIMPLE HARMONIC OSCILLATOR
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THE SIMPLE HARMONIC OSCILLATOR
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The potential energy of the system is,
Where the angular frequency of vibration is
/
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THE SIMPLE HARMONIC OSCILLATOR
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Classical Results:
Classically, the particle oscillates between the points , where A is the amplitude of themotion.
In the classical model, any value of E is allowed, including E = 0,which is the total energy when the particle is in rest at x= 0.
Its total energy
+
( )
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THE SIMPLE HARMONIC OSCILLATOR
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The solution of the above equation is given by
The constant B can be determined from the normalization
condition.
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The Schrdinger equation for this problem is
+
/ and E=
/
THE SIMPLE HARMONIC OSCILLATOR
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The energy levels of a harmonic oscillator are quantized. The energy
for an arbitrary quantum number n is given by
The state n = 0 corresponds to the ground state, whose energy is
(); the state n = 1 corresponds to the first excitedstate, whose energy is E1 = (3/2), and so on.
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+ + /
THE SIMPLE HARMONIC OSCILLATOR
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Energy level diagram for a
simple harmonic oscillator,superimposed on the
potential energy function.
The levels are equally
spaced with .The ground state energy is
().
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THE SIMPLE HARMONIC OSCILLATOR
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The classical and quantum mechanical probabilities
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The dotted curves represent the classical probabilities and the blue ones the
quantum probabilities for a simple harmonic oscillator.
THE SIMPLE HARMONIC OSCILLATOR
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The classical and quantum mechanical probabilities
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The dotted curves represent the classical probabilities and the blue ones the
quantum probabilities for a simple harmonic oscillator.
THE SIMPLE HARMONIC OSCILLATOR
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In classical physics, probability densities are the greatest near the
endpoints of its motion where it has the least kinetic energy. This is
in sharp contrast to the quantum case for small n. In the limit of large
n, the probabilities start to resemble each other more closely as
shown in figure.
Planks equation for the energy levels of the oscillators differs from
the equation given by quantum harmonic oscillator only in the term
added to n. However this additional term does not affect theenergy emitted in a transition.
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QUESTIONS QUANTUM MECHANICS
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MIT-MANIPALBE-PHYSICS-QUANTUMMECHANICS-2010-2011 65
[MARKS]1. What is a wave function ? What is its physical
interpretation ? [2]2. What are the mathematical features of a wavefunction? [2]
3. By solving the schrdinger equation, obtain the wave-
functions for a particle of mass m in a one-dimensional box of length L. [5]
4. Apply the schrodinger equation to a particle in aone-dimensional box of length L and obtain the
energy values of the particle. [5]
5. Sketch the lowest three energy states, wave-functions, probability densities for the particle in a
one-dimensional box. [3]
QUESTIONS QUANTUM MECHANICS
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MIT-MANIPALBE-PHYSICS-QUANTUMMECHANICS-2010-2011 66
[MARKS]
6. The wave-function for a particle confined to moving
in a one-dimensional box is
Use the normalization conditionon to show that [2]
7. The wave-function of an electron is
Obtain an expression for the probability of findingthe electron between x = a and x = b. [3]
QUESTIONS QUANTUM MECHANICS
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[MARKS]
8. Sketch the potential-well diagram of finite height U
and length L, obtain the general solution of theschrodinger equation for a particle of mass m in it.[5]
9. Sketch the lowest three energy states, wave-functions, probability densities for the particle in apotential well of finite height. [3]
10.Give a brief account of tunneling of a particlethrough a potential energy barrier. [4]
11. Give a brief account of the quantum treatment of asimple harmonic oscillator. [5]