Quantum PhysicsS1
Quantum PhysicsS1
Due to absorption of radiation, temperature of the body increases and it starts emitting radiation
from narrow hole. This radiation contains all wavelengths. It is called as black body radiation.
When intensity vs wavelength curve is plotted, it is found that radiation for longer wavelengths is
very low. For shorter wavelengths, intensity is more. For a particular wavelength, 𝜆max,
maximum energy is radiated. This is called peak wavelength.
Even though all wavelengths are emitted, there is a maximum intensity only for a peak
wavelength. Black body appears of the colour corresponding to that wavelength.
If we increase temperature of the black body, 𝜆max shifts towards left side and the colour of the
black body changes.
1
This shift in the peak wavelength was explained by Wien‟s displacement law as - 𝜆 max ⍺ T
But taw could explain the part of the curve towards the lower wavelengths. Also, if the
temperature is close to zero, 𝜆max will be infinite. But when the temperature is lowered, the
radiation curve changes the behaviour which could not be explained.
Rayleigh and Jean also tried to explain this radiation curve using their Rayleigh-Jeans radiation
law based on classical statistics. As per this law, energy density is proportional
to square of the frequency i.e. inversely proportional to square of the wavelength. This law is
applicable to higher wavelengths. But fails at the lower wavelengths.
Max Planck suggested that radiated energy must be depending on the frequency of radiation. He
represented this energy E = hv and replaced the average energy kT in Rayleigh-Jeans radiation
calculated by him using Maxwell-Boltzmann distribution.
This equation now, gives correct explanation for the black body radiation curve. Thus, while
explaining black body radiation, Planck introduced a revolutionary idea which says – “Energy of
radiation depends on frequency (E = hv).”
Einstein used idea of Planck to explain his photoelectric effect. He confirmed that light consists
of discrete units of energy known as photons carrying energy - E = hv. Thus, photoelectric effect
confirmed the particle nature of light. Wave nature of light is already known due to phenomena
like interference, diffraction, polarization etc. This dual nature of light is known as wave-particle
duality.
Also, Motion of macroscopic particles can be explained by classical theory of Mechanics. But it
fails to explain the motion of microscopic particles like electron, proton etc. Quantum mechanics
was developed from Quantum theory to explain the properties associated with such particles. de
Broglie wave-particle duality hypothesis, Heisenberg‟s Uncertainty Principle and Schrodinger‟s
equation provide base on which quantum mechanics is built.
De Broglie Hypothesis
It states that - There is a wave associated with every moving particle moving with velocity v, and
h h
the wavelength of this wave is given by – 𝜆 = =
p mv
Let us consider the case of the photon. Energy of the photon, according to Plank’s theory of
radiation is given by –
E = h (1)
where h is Plank’s constant and is frequency of radiation.
If we consider a photon as a particle of mass m, its energy is given by Einstein Mass Energy
relation as –
E = m c2 (2)
From equation (1) and (2), we get,
h = m c 2 = (3)
As photon travels with velocity of light “c” in free space, its momentum “p” is given by –
de Broglie assumed that above relation holds good for all material particles like electrons,
neutrons etc. For such particles,
h h
𝜆= =
p mv
where „m‟ is the mass of the particle and „v‟ is the velocity of the particle.
nh
L = n =
2
We may consider the stationary electron orbits in an atom to be analogous to the circular loop of
string. The stationary electron-wave pattern can form in the orbit if an integral number of
electron wavelengths fit into the orbit as shown in following fig.
h
2 r = n = n
h
Thus, circumference of the as = from De Broglie hypothesis.
orbit mv mv
h
m vr = n
2
L = n Where L = mvr is angular momentum
Thus Bohr’s postulate can be obtained using De Broglie Hypothesis. So if Bohr’s postulate is
true, De Broglie Hypothesis is also true.
Consider a particle moving with velocity v. Its momentum p = mv and the de Broglie wavelength
of matter wave associated with it is given by –
h h
λ = = − − − − − − − − − − − − − − − − −(1)
p mv
The Kinetic energy of the particle is –
1 1 1 2
E = mv2 = m2 v2 = p
2 2m 2m
p2 = 2mE
p = 2mE − − − − − − − − − − − − − − − − − − − − −(2)
h
λ =
2mE
The first experimental evidence of de Broglie hypothesis came from the experiments performed
by Davisson and Germer. Following figure shows the experimental arrangement used by
Davisson and Germer.
In this experiment, the beam of electrons was made to fall normally on the surface of a crystal
and then the collector (C) was moved to various positions on the scale. The galvanometer current
for each position was noted. This current is a measure of the intensity of the diffracted beam of
electrons. Graph of this current (intensity of diffracted beam) against the angle between the
incident beam and the beam entering the collector was plotted. This procedure was repeated for
different voltages and several curves were drawn as shown in following Fig.-
In one set of experiment, Davisson and Germer found that when the accelerating potential is
raised to 54 volts, a maximum appears when the angle between incident and diffracted beam (=
) was 500 for the first order spectrum. This maximum confirms the existence of diffraction
phenomenon and hence the wavelike behavior of electrons. Hence, by using the de Broglie
relation, the wavelength of the wave associated with the electron can be calculated and is given
by – h = 6.6210-34 Joules - sec, m = 9.110-31 Kg, e = 1.6 10-19 Coulomb, V = 54 volts
h h 6.6210-34
λ = = =
p 2meV 2 9.110-31 1.6 10-19 54
= 1.67 10-10 m = 1.67 A0
The wavelength of the wave can also be calculated by using Bragg’s relation which is
established result in optics.
ℎ 6.63 × 10−34
𝜆= =
√2𝑚𝑒𝑉 √2 × 9.1 × 10−31 × 1.6 × 10−19 × 200
2dsinθ = nλ
λ
= sin−1 ( 8.688 × 10 ) = 8.320
−11
∴ θ = sin−1
2d 2 × 3 × 10−10
2. Calculate the wavelength of the wave associated with a neutron moving with energy 0.025 eV. Mass
ofneutron is 1.676 x 10-27 kg.
Given : h = 6.63 × 10−34J. s, m = 1.676 × 10−27kg
E = 0.025 eV = 0.025 × 1.6 × 10−19 J
𝜆=?
h h 6.63 × 10−34
𝜆= = =
p √2mE √2 × 1.676 × 10−27 × 0.025 × 1.6 × 10−19
= 1.811 × 10−10m
3. Calculate the de Broglie wavelength of the proton moving with a velocity equal to 1 th of velocity of
20
4. Calculate velocity and de Broglie wavelength of an 𝑎 − particle of energy 1 keV. Mass of 𝑎 − particle
is 6.68 x 10-27 kg.
Given : h = 6.63 × 10−34J. s, m = 6.68 × 10−27kg
E = 1 keV = 1000 × 1.6 × 10−19 J
v=? 𝜆=?
h h 6.63 × 10−34
𝜆= = =
p √2mE √2 × 6.68 × 10−27 × 1000 × 1.6 × 10−19
= 4.535 × 10−13m
5. An enclosure filled with helium is heated to 400K. A beam of He-atoms emerges out of the enclosure.
Calculate the de Broglie wavelength corresponding to He-atoms. Mass of He-atoms = 6.7 x 10-27 kg.
𝐺i𝑣𝑒𝑛 : ℎ = 6.63 × 10−34𝐽. 𝑠, 𝑚 = 6.7 × 10−27𝑘𝑔
3 3
𝐸 = 𝑘𝑇 = × 1.38 × 10−23 × 400 = 8.28 × 10−21𝐽
2 2
𝜆 =?
ℎ ℎ 6.63 × 10−34
𝜆= = =
𝑝 √2𝑚𝐸 √2 × 6.7 × 10−27 × 8.28 × 10−21
= 6.294 × 10−11𝑚 = 0.6294 𝐴0
6. Find the energy of neutron in units of electron volt whose de Broglie wavelength is 1A0. Given – mass of
neutron = 1. 674 × 10−27kg
Given : h = 6.63 × 10−34J. s, m = 1.674 × 10−27kg
𝜆 = 1 A0 = 10−10m, E =?
h h h2 (6.63 × 10−34)2
𝜆= = ∴E= =
p √2mE 2m𝜆2 2 × 1.674 × 10−27 × (10−10)2
1.313 × 10−20
= 1.313 × 10 J =
−20 = 0.082 eV
1.6 × 10−19
7. A bullet of mass 40 gm and an electron both travel with the velocity of 1100 m/s. What wavelengths can
be associated with them? Why the wave nature of bullet cannot be revealed using diffraction effect?
𝑖) 𝐹𝑜𝑟 𝑒𝑙𝑒𝑐𝑡𝑟𝑜𝑛,
𝐺𝑖𝑣𝑒𝑛 : ℎ = 6.63 × 10−34𝐽. 𝑠, 𝑚 = 9.1 × 10−31𝑘𝑔, 𝑒 = 1.6 × 10−19𝐶
𝑚
𝑣 = 1100 , 𝜆 =?
𝑠
ℎ 6.63 × 10−34
𝜆= =
𝑚𝑣 9.1 × 10−31 × 1100
ℎ 6.63 × 10−34
𝜆= =
𝑚𝑣 40 × 10−3 × 1100
= 1.507 × 10−35𝑚
As the wavelength associated with bullet is of the order of 10-35m, to reveal the
wave nature of wave associated with bullet, a diffraction grating having width
of the slit of the order of 10-35m is needed. Such diffraction grating is not
available. So, the wave nature of the bullet cannot be revealed.
8. Find the energy of neutron in units of electron volt whose de Broglie wavelength is 1A 0. Given – mass of
neutron = 1. 674 × 10−27kg
Given : h = 6.63 × 10−34J. s, m = 1.674 × 10−27kg
𝜆 = 1 A0 = 10−10m, E=?
h h
𝜆= =
p √2mE
h2 (6.63 × 10−34)2
E= =
2m𝜆2 2 × 1.674 × 10−27 × (10−10)2
1.313 × 10−20
= 1.313 × 10−20J = = 0.082 eV
1.6 × 10−19
9. An electron accelerated through 1000 volts and is reflected from a crystal. The first order reflection
occurs when glancing angle is 700. Calculate the interplanar spacing of the crystal.
Given : h = 6.63 × 10−34J. s, m = 9.1 × 10−31kg,
e = 1.6 × 10−19C, V = 1000 volts, n = 1, 𝜆 =? d =?
h 6.63 × 10 −34
𝜆= =
√2meV √2 × 9.1 × 10−31 × 1.6 × 10−19 × 1000
= 3.885 × 10−11m
Using Bragg‟s law, 2 d sin𝜃 = n𝜆
n𝜆 1 × 3.885 × 10−11
∴d= =
2 sin𝜃 2 × sin70
= 2.067 × 10−11m = 0.2067 A0
10. An electron accelerated through 100 volts are reflected from a crystal. Calculate the glancing angle at
which the first order reflection occurs. Given lattice spacing = 2.15 A0.
Given : h = 6.63 × 10−34J. s, m = 9.1 × 10−31kg, d = 2.15 × 10−10m
e = 1.6 × 10−19C, V = 100 volts, n = 1, 𝜆 =? 𝜃 =? ,
h 6.63 × 10−34
𝜆= =
√2meV √2 × 9.1 × 10−31 × 1.6 × 10−19 × 100
= 1.229 × 10−10m
Using Bragg‟s law, 2 d sin𝜃 = n𝜆
n𝜆 1 × 1.229 × 10−10
∴ 𝜃 = sin−1 ( ) = sin−1 ( )
2d 2 × 2.15 × 10−10
∴ 𝜃 = 16.610
11. An electron and photon each have a wavelength of 2 A0. What are their momentum and energy?
Mass of neutron = 1. 676 × 10−27kg, Mass of electron = 9. 1 × 10−31kg,
Planck′s constant = 6. 63 × 10−34J. s
Given:
Mass of neutron = 1.676 × 10−27kg, Mass of electron = 9.1 × 10−31kg,
Planck′s constant = 6.63 × 10−34J. s, 𝜆 = 2 × 10−10m
For an electron,
h 6.63 × 10−34 kg. m
momentum, p = = = 3.315 × 10−24
𝜆 2 × 10−10 s
p2 2
(3.315×10−24 )
Energy, E = = = 6.038× 10−18J
2m 2×9.1×10−31
For an photon,
h 6.63 × 10−34 k g. m
momentum, p = = = 3.315 × 10−24
𝜆 2 × 10−10 s
hc 6.63×10−34×3×108 = 9.945× 10−16J
Energy, E = hv = ℎ
= 2×10−10
According to the classical mechanics, the position and momentum of the moving particle can be
determined with great accuracy. However, when the particle is considered as a wave, it is not
possible to know the exact location of the particle on the wave as the wave extends throughout
the region in the space.
The de Broglie wavelength associated with a moving particle traveling with a uniform velocity
‘v’ is given by –
h
λ =
mv
This is a monochromatic wave of infinite extent. The phase velocity ‘vp’ of such monochromatic
wave is given by –
hλ h E mc2 c2
vp = λ = = = = = --------------------(1)
h h p mv v
λ
This phase velocity is always greater than the velocity of light in vacuum. Hence it is
theoretically impossible for a monochromatic de Broglie wave-train to transport a particle or
energy.
Further the stability of the material particle demands that it should be concentrated over a small
region of space at any instant of time. Thus, mass of a particle is a localized entity whereas the
de Broglie wave with which we represent the moving particle of infinite extent.
From Einstein’s theory of velocity, it follows that the speed of light is maximum velocity that
can be attained by a particle in nature. It means that the velocity of the particle ‘v’ is always less
than the speed of light ‘c’. From equation (1) it follows that the de Broglie wave velocity must be
greater than ‘c’, which is not acceptable. Further, it follows from this result, that the wave
associated with the particle would travel faster than the particle itself, thereby leaving the particle
far behind. Hence it was concluded that a material particle would not be equivalent to a single
wave-train.
Schrodinger solved this difficulty by postulating that a material particle in motion is equivalent
to a wave packet rather than a single wave. A wave packet consists of a group of waves (each
having slightly different velocity and wavelength). The phases and amplitudes of these waves are
chosen in such a way that they undergo interference constructively over only a small region of
space where the particle can be located. Outside this region, they undergo destructive
interference so that that the amplitude reduces to zero rapidly. Such wave packet is shown in the
following figure-
This wave packet moves with its own velocity ‘vg’, called as group velocity. The individual
waves forming the packet have an average velocity ‘vp’ called as a phase velocity. It can be
proved that the velocity of the material particle is same as the group velocity of wave packet.
The phase velocity is the velocity with which a particular phase of the wave propagates in the
medium.
Let the equation of the wave travelling in x-direction with vibrations in y-direction is –
y = A sin(t - kx)
where A = amplitude of vibration,
2
k= is propagation constant, = 2 is angular frequency
2
= and =
2 k
2
phase velocity, vp = = = ---- (1)
2 k k
wavelength of De Broglie wave associated with a particle of mass ' m' moving with
velocity ' v' is given by -
2 2 m v
=
h k = =
mv h
To find frequency ( ), let us equate energy e with relativistic total energy mc2
mc2 2 m c 2
i.e. h = mc2 = and = 2 =
h h
2 m c 2
h c2
from (1), phase velocity (vp ) = = =
k 2 m v v
h
Thus, the phase velocity of the wave under consideration is always greater than the velocity of
light. Further the stability of the material particle demands that it should be concentrated over a
small region of space at any instant of time. Thus, mass of a particle is a localized entity whereas
the single monochromatic wave with which we represent the moving particle of infinite extent.
So, a single monochromatic wave cannot be associated with the moving particle.
Schrodinger postulated that a material particle in motion is equivalent to a wave packet rather
than a single wave. A wave packet consists of a group of waves (each having slightly different
velocity and wavelength). The phases and amplitudes of these waves are chosen in such a way
that they undergo interference constructively over only a small region of space where the particle
can be located. Outside this region, they undergo destructive interference so that that the
amplitude reduces to zero rapidly. Such wave packet is shown in the following figure-
This wave packet moves with its own velocity ‘vg’, called as group velocity. The individual
waves forming the packet have an average velocity ‘vp’ called as a phase velocity. It can be
proved that the velocity of the material particle is same as the group velocity of wave packet.
If two waveshave their angular velocities differing by d and
propagation constantsdiffering by dk (due to difference d in their wavelengths),
their equations can be written as -
y1 = A sin (t - kx)
and y2 = A sin [( + d)t - (k + dk)x]
The resultant displacement ' y' at time ' t' is - y = y1 + y2
The sine term in the above equation represents a wave of angular frequency and
propagation constant k.
d
The cosine term modulates this wave with angular frequency to produce
2
d
wavegroups traveling with velocity vg = which is group velocity.
dk
d
= dv
vg dk - - - - - - - - - - - - - -(2)
dv
The association of group of waves (wave packet) with a moving particle means that, the position
of the particle at any instant of time cannot be specified with desired degree of accuracy. All that
we can say is, the particle is somewhere within the wave packet. The probability of finding the
particle at a point in a wave packet is directly proportional to the amplitude of the wave at that
point.
If the width of the wave packet is small as shown in fig. (a) then the particle can be located
somewhat accurately, but the determination of wavelength (And hence the momentum) becomes
a problem. If width of the wave packet is more (fig. (b)), then wavelength measurement (and
hence determination of momentum) is accurate. However, position of the particle cannot be
determined accurately.
With this discussion, Heisenberg, put forward his uncertainty principle which states that –
It is impossible to determine simultaneously, the position and momentum of the moving particle
accurately. In any simultaneous determination of position and momentum of the particle, the
product of uncertainties is equal to or greater than
As we do not have any ideal instruments, these experiments are performed in thought without
violating any physics concepts. Hence, they are called as thought experiments or hypothetical
experiments.
In this experiment, we try to measure both position and momentum of electron. For this, let us
set up a high power -ray microscope as shown in the following fig.
Let ‘O’ be the electron, ‘’ be the wavelength of -rays and ‘’ be the semi-vertical angle of the
cone of rays that enter the microscope objective. As the gamma ray photons collide with
electrons, some of them bounce into the microscope and enable the observer to see the electron.
According to the classical mechanics, the observer should be able to find out the exact position
and momentum of the electron. However, there are two fundamental limitations in this
experiment –
i) The accuracy in determining the position of electron by a microscope is limited by the
laws of Optics. According to Optics, the resolving power of a microscope is given by –
λ
x =
2 sin
where x is minimum distance between two points that can be distinguished as separate.
is wavelength of scattered gamma ray photon.
Due to this, if position of the electron changes by x, the microscope would not be able
to detect it. To make x very small, radiation of very short wavelength such as X-rays or
Gamma rays should be used. Thus x will be an error or uncertainty in determination of
position of the electron.
λ
x = (1)
2 sin
ii) While determining the momentum of the electron, the interaction of electron with gamma
ray photon will result in change of momentum of electron because of its recoil.
In order that this change is to be as small as possible, consider a single gamma ray photon
incident on an electron along the X-axis. A scattered photon of wavelength ‘’ will enter
the objective anywhere between OA and OB. The momentum of scattered photon is p. If
it enters the objective along OA, X-component of its momentum would be + p sin
Hence, momentum imparted to the electron along X - axis p' - p sin − − − − (2)
=
If scattered photon enters the microscope along OB, then X-component of its momentum
would be − p sin
The momentum given to the electron can therefore have any value between those given
Hence, momentum imparted to the electron along X - axis = p' - (- p sin )
= p' + p sin − − − − (3)
by equation (2) and (3)
px = p' + p sin - (p' - p sin )
h
px = 2 p sin = 2 sin --------------------------------(4)
λ
From equation (1) and (4), the product of uncertainties is given by –
λ h
x . px = . 2 sin
2 sin λ
h
= h
4π
Which confirms the HUP.
Consider a narrow-slit AB of width x as shown in the figure. Let a beam of electrons fall on this
slit. After passing through the slit, the electron beam produces a diffraction pattern containing a
central maximum. The first minimum is obtained on either side of the central maximum at an
angle given by the relation –
We cannot locate the exact position of the electrons in the beam when it passes through the slit.
The uncertainty in the measurement of the position of the electron n the slit is equal to the width
of the slit, which is given by –
λ
Δx = − − − − − − − − − − − − − − − − − − − − − − − − (2)
sin θ
Let p be the momentum of the electron. The electron can be incident on the screen anywhere
between central position and the first minimum. If the electron moves in the direction EC after
diffraction, the change in momentum ‘p’ is given by
Δp = p sin θ ( 3)
Δx Δp
λ
= p sin θ
sin θ
h h
= λ p = p = h
p 4π
In any simultaneous determination of the time and energy of the particle, the product of
uncertainties is equal to or greater than Planck’s constant ‘h’.
h
i.e. E . t
4π
where E is the fundamental error or uncertainty in measurement of energy and
t is fundamental error or uncertainty in measurement of time.
Let us consider a particle of mass ‘m’ moving with a velocity ‘v’ so that its K.E. is –
1
E = mv2
2
1
E = m 2 v v
2
= vp (∵ mv = p)
x x
= p (v = )
t t
h
E . t = x . p
4π
Problems based on HUP:
1. A position and momentum of 1 keV electron are simultaneously measured. If position is located
within 10 nm then what is the percentage uncertainty in its momentum?
∆𝑝 5.275 × 10−27
× 100 = × 100 = 0.0391
𝑝 1.706 × 10−23
2. An electron has a speed of 400 m/s with uncertainty of 0.01%. Find the accuracy in its position.
𝑚 ∆𝑣 0.01
𝐺i𝑣𝑒𝑛 : 𝑣 = 400 , = , 𝑚 = 9.1 × 10−31 𝑘𝑔,
𝑠 𝑣 100
ℎ = 6.63 × 10−34, ∆𝑥 =?
𝑘𝑔. 𝑚
𝑝 = 𝑚 𝑣 = 9.1 × 10−31 × 400 = 3.64 × 10−28
𝑠
∆𝑣 ∆𝑣 0.01 𝑘𝑔. 𝑚
∆𝑝 = 𝑚 ∆𝑣 = 𝑚 𝑣 =𝑝× = 3.64 × 10−28 × = 3.64 × 10−32
𝑣 𝑣 100 𝑠
ℎ
𝐴𝑐𝑐𝑜𝑟𝑑i𝑛𝑔 𝑡𝑜 𝐻𝑈𝑃, ∆𝑥. ∆𝑝 ≥
4𝜋
ℎ 1 6.63 × 10−34
∴ ∆𝑥 ≥ × =
4𝜋 ∆𝑝 4 × 3.142 × 3.64 × 10−32
∆𝑥 = 1.449 × 10−3𝑚
3. An electron has a speed of 900 m/s with an accuracy of 0.001%. Calculate the uncertainty in the
position of the electron.
𝑚 ∆𝑣 0.001
𝐺i𝑣𝑒𝑛 : 𝑣 = 900 , = , 𝑚 = 9.1 × 10−31 𝑘𝑔,
𝑠 𝑣 100
ℎ = 6.63 × 10−34, ∆𝑥 =?
𝑘𝑔. 𝑚
𝑝 = 𝑚 𝑣 = 9.1 × 10−31 × 900 = 8.19 × 10−28
𝑠
∆𝑣 ∆𝑣 0.001 𝑘𝑔. 𝑚
∆𝑝 = 𝑚 ∆𝑣 = 𝑚 𝑣 =𝑝× = 8.19 × 10−28 × = 8.19 × 10−33
𝑣 𝑣 100 𝑠
ℎ
𝐴𝑐𝑐𝑜𝑟𝑑i𝑛𝑔 𝑡𝑜 𝐻𝑈𝑃, ∆𝑥. ∆𝑝 ≥
4𝜋
ℎ 1 6.63 × 10−34
∴ ∆𝑥 ≥ × =
4𝜋 ∆𝑝 4 × 3.142 × 8.19 × 10−33
∆𝑥 = 6.44 × 10−3𝑚
5. An electron confined in a box of length 10-8 m. Calculate minimum uncertainty in its velocity.
* dxdydz = 1
−
SCHRODINGER’S EQUATION
It is an equation which describes the behaviour of the wave function associated with microscopic
particles.
According to the De Broglie theory, a particle of mass ‘m’ moving with velocity ‘v’ is associated
h
with a wave of wavelength λ = . Though, we do not know, what it is that vibrates, this
mv
vibration is represented by ‘’, the periodic changes which are responsible for
h
λ = (1)
mv
The wave equation of stationary wave associated with the particle in terms of Cartesian co-
ordinate system at any instant is given by –
ψ = ψ0 sin ωt
Differentiating it further –
2ψ
= - ψ 0 4π2 2 sin 2πt
t 2
2ψ
= - 4π2 υ2 ψ (6)
t 2
velocity (v)
Also, frequency () =
wavelength ()
Equation (6) becomes) –
2ψ 4π2 v2
= - ψ (7)
t 2 2
From equation (4) and (7) we get –
2 ψ 4π2 v2
2
v = - ψ
x2 2
2ψ 4π2
+ ψ = 0 ---------------------------------------- (8)
x2 2
h
Now, we will introduce wave mechanical concept by replacing by from De Broglie
mv
theory. Thus equation (8) becomes –
2ψ 4π 2 m 2 v2
+ ψ = 0 ------------------------------------- (9)
x 2 h2
The total energy of electron E is given by the sum of its kinetic energy and potential energy.
This equation (11) is known as one dimensional Schrodinger’s Time Independent Equation. This
is also termed as Schrodinger’s fundamental wave equation with respect to space.
This equation is independent of time and gives a steady value. It is particularly useful when the
energy of the particle is very small as compared to its rest energy. In most atomic problems,
energy of the particle is very small when compared to rest energy.
Let us consider a free particle of mass ‘m’ moving with velocity ‘v’ in one dimension. Let ‘p’ be
the momentum and ‘E’ be the energy of the particle. By the term free particle, it means that no
forces are acting on it and its total energy E is entirely kinetic energy.
This moving particle is associated with De Broglie waves which have wavelength and
frequency . These are related as –
----------------------------------------- (2a)
----------------------------------------- (2b)
2π
Where k = represents the propagation constant and = 2 represents angular
λ
frequency of the waves.
ħ2
ħω = k2 (3)
2m
Now, a wave equation is needed which will describe these traveling waves. This wave equation
will also involve equation (3) in it. Further the function should be harmonic one, because such
functions can be superimposed, thereby giving a wave packet which will represent a particle. It
means that it must be sine, cosine or exponential function of (kx – wt). Let Such function is
ψ = A ei(kx - wt) .
Now,
And,
If we include the effect of forces acting on the particle i.e. when the particle is not free, the
potential energy of the particle is V.
This equation (1.6.7) represents the Schrodinger’s Time Dependent Equation (STDE).
Physical significance of STIE and STDE is that it is used to find the allowed energy levels of
quantum mechanical systems. The associated wave function gives the probability of finding
position of the particle. As Newton’s laws predict the future behavior of a dynamic system in
classical mechanics, Schrodinger’s equations are used to predict future behavior in quantum
mechanics.
a
The particle is free to move within the walls from − to +
a
as there is no potential in that
2 2
region.
At boundaries, potential is . Therefore, the particle can neither cross these boundaries nor it can
a
be located at x = .
2
a a
and its derivatives are finite, continuous and single valued within − x + but it is
2 2
discontinuous at boundaries and does not exist outside the boundaries.
Only real part solution is required as the particle must be present somewhere within the well
(box).
d2 (x)
+ V(x) (x) = E (x) --------------------------------- (1)
dx 2
a a
for region between − x + ; V=0
2 2
d2 (x) = E
(x)
dx 2
d2 (x) 2mE
2
+ (x) = 0 --------------------------------- (2)
dx 2
ka
2 B cos = 0
2
n
kn = ; n = 1, 3, 5, ......... ---------------------- (6)
a
Subtracting (1.7.5) from (1.7.4),
ka
2 B sin = 0
2
n
kn = ; n = 2, 4, 6, ......... ---------------------- (7)
a
Now, momentum of the particle is given by –
1. An electron is bound in a one-dimensional potential well of width 2 A0 and of infinite height. Find its
energy values in ground state and first two excited states.
Given : m = 9.1 × 10−31 kg, a = 2 × 10−10m
h = 6.63 × 10−34, E0, E1 , E2 =?
n2h2
E=
8 m a2
For ground state, n = 1, E = E0
n2h2 12 × (6.63 × 10−34)2
∴ E0 = = = 1.5 × 10−18J
8ma 2
8 × 9.1 × 10−31 × (2 × 10−10)2
For first excited state, n = 2, E = E1
n2h2 22 × (6.63 × 10−34)2
∴ E1 = = = 6 × 10−18J
8 m a2 8 × 9.1 × 10−31 × (2 × 10−10)2
For second excited state, n = 3, E = E2
n2h2 32 × (6.63 × 10−34)2
∴ E2 = = = 1.35 × 10−17J
8 m a2 8 × 9.1 × 10−31 × (2 × 10−10)2
Quantum Computing
Quantum computing means developing a computer that uses quantum mechanical phenomena to
perform operations on data through devices such as superposition and entanglement.
Quantum computing uses the power of atoms and molecules to perform memory and processing
tasks.
Quantum computing uses quantum bits or qubits which can either take value 0 or 1 or both
simultaneously.
A bit of data is represented by a single atom that is in one of two states denoted by |0> and |1>.
A single bit of this form is known as a qubit
A physical implementation of a qubit could use the two energy levels of an atom. An excited
state representing |1> and a ground state representing |0>.
2 Information storage is bit based on voltage Information storage is Quantum bit based
or charge etc. on direction of an electron spin.
5 Classical computers use binary codes i.e. Quantum computers use Qubits i.e. 0, 1
bits 0 or 1 to represent information. and both of them simultaneously to run
machines faster.
8 Circuits are easily implemented in fast, Circuits must use microscopic technologies
scalable and macroscopic technologies that are slow, fragile and not yet scalable
such as CMOS. e.g. NMR (Nuclear magnetic resonance).