Schrodinger Equation. Concepts and problems in Quantum Mechanics. Part-I
Chapter 1: Review of Quantum MechanicsThe treatment below of quantum mechanics starts from a...
Transcript of Chapter 1: Review of Quantum MechanicsThe treatment below of quantum mechanics starts from a...
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Chapter 1: Review of Quantum Mechanics A Very Brief History of Quantum Mechanics The Period of Discovery: In 1900, a German physicist Max Planck made the discovery that the energy of electromagnetic radiation of a mode of frequency cannot take continuous values and the energy can only be increased or decreased in discrete jumps equal to , where is the Planck’s constant with a value equal to 1.05458x10-34 Joules-sec. Plank called this much amount of energy a “quantum” of energy. These days we call this energy “quantum” a “photon”. Planck’s discovery led Einstein to hypothesize in 1905 that light (which was known by then to be an electromagnetic wave) is made up of particles (i.e. photons) each having an energy E equal to ,
2c
E
This hypothesis enabled Einstein to explain the experimental observations of the photoelectric effect. For an electromagnetic wave in free space, the ratio of energy to velocity c equals the momentum. Therefore, the momentum p associated with a single energy quantum (or a photon) is,
2
2
Ep
c c
p
In 1924, a French physicist Louis De Broglie concluded that since light seems to display particle-like qualities, it might also be possible that particles display wave-like qualities. To quantify this correspondence, he hypothesized that a particle of momentum p mv (where m is the mass of the
particle and v is its velocity) would behave like a wave of wavelength given by essentially the same equation as the one above for a photon,
2
p
This was a bold hypothesis. During 1923-1927, Clinton Davisson and Lester Germer at Bell Labs experimentally confirmed the wave behavior of electrons via the diffraction of electron beams from atomic planes of a crystal (much like the diffraction of x-rays from these atomic planes) and verified the De Broglie hypothesis. During the 1910s and 1920s, Niels Bohr, a Danish Physicist, was studying the behavior of electrons in atoms. Bohr could explain most of the experimental observations related to the light frequencies that were emitted from atoms if he assumed that the angular momentum L of electrons in atoms can only take discrete values that are integral multiples of , 1,2,3....L n n
De Broglie’s hypothesis naturally led to the above rule if one takes an electron in an atom to be a wave that is moving in a circular orbit around the nucleus. The circumference 2 r of the orbit must then be an integral multiple of the electron wavelength for the electron wave to “fit” in the orbit,
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2 1,2,3....r n n
Multiplying the above equation on both sides by the electron momentum p , using the De Broglie’s
relation, and noting that L r p , one obtains Bohr’s condition.
The Wave Equation for Matter? By mid 1920s, the wave nature of matter particles was becoming more and more evident. All known waves at that time (electromagnetic waves, sound waves, etc) were known to obey a wave equation. The question then was what wave equation do the matter particles obey. A brief suggestive reasoning for obtaining the wave equation for matter particles is given below. Let’s start from the electromagnetic waves. In the case of electromagnetic waves in free space, the 1-
dimensional wave equation for the electric field ,E x t
is,
2
2
2
22
1, ( , )E x t
c t
E x t
x
The solutions of the above equation are complex exponentials,
2
ˆ,i x i t
oE x t nE e
If the above solution is plugged into the wave equation, then the wave velocity, wavelength, and frequency are found to be related by,
2c
Multiplying both sides by one obtains,
2
E c pc
which is the expression for the energy of a light quantum (or a photon). Notice the energy scales linearly with the photon momentum. We can write the wave solution as,
ˆ,pi x i t
oE x t nE e
where pc
In contrast, the energy E of a matter particle of mass m and velocity v is quadratic in the momentum,
22 2
21 2
2 2 2
pE mv
m m
The last equality above follows from the De Broglie’s hypothesis. If we now divide both sides by we get,
21
2
E p
m
Therefore, if a matter particle is to be described by a wave equation then the frequency of that wave, given by E , must be related to the momentum and the wavelength via,
221 2
2 2
E p
m m
Suppose a matter particle is indeed described by a wave, and the wave has the standard form (borrowing from electromagnetism),
2
,p
i x i t i x i tx t Ae Ae
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then we need to find out what kind of wave equation would give the following relation,
221 2
2 2
p
m m
when the above wave solution is plugged into it? The linear dependence on frequency on the left hand side and the quadratic dependence on the momentum on the left hand side leave little room for guessing and the answer is simple,
2
2
( , ),
2
x ti
m x
x t
t
If one plugs the assumed solution,
2
,p
i x i t i x i tx t Ae Ae
into the wave equation above, one obtains,
221 2
2 2
p
m m
as desired! The above wave equation for the matter particle is more commonly written as (after multiplying on both sides by ,
22
2
( , ),
2
x ti
m x
x t
t
This is the famous Schrodinger equation for a particle in free space, hypothesized by Erwin Schrodinger, an Austrian physicist, in 1926. Note that the left hand side of the Schrodinger equation above gives the energy of the particle when the assumed wave solution,
2
,p
i x i t i x i tx t Ae Ae
is plugged into it,
22 2 2 2
2 2
,
2 2 2
p pi x i t i x i tx t p
Ae Aem m mx x
For a particle in free space, this energy is purely kinetic and equal to 2 2p m . If the particle experiences
a space-dependent potential energy V x then it must also be added to the left hand side as follows,
22
2
,,
( )
2
,x tV x x t i
x
x
t
tm
The above is the complete form of the time-dependent Schrodinger equation. Problems of Interpretation: Even after the discovery of the Schrodinger equation, the quantum puzzle was far from being solved. Many questions arose immediately. What did the complex wave amplitude ,x t represent? What is
oscillating in the wave associated with a matter particle? These questions were answered in the decades that followed. Max Born, a German physicist, played an important role in these developments. Born
identified the positive semi-definite quantity 2,x t with the probability of finding the matter particle
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at location x if a measurement is made at time t to locate the particle. This interpretation of ,x t was
consistent with all experimental observations but it brought in a probabilistic description of reality which before quantum mechanics was considered to be deterministic. A more complete picture of the quantum mechanical behavior of particles took more decades more to formulate and it is still a work in progress with many unanswered questions. The treatment below of quantum mechanics starts from a different starting point, but eventually the same Schrodinger equation is derived.
1.1 Postulates of Quantum Mechanics 1.1.1 Postulates One, Two, and Three There are several postulates of quantum mechanics. These are postulates since they cannot be derived from some other deeper theory. They are known only from experiments. The first few are:
1) The state of physical system at time ‘ t ’ is described by a vector (or a ket), denoted by )(t ,
that belongs to a Hilbert space. The state vector captures all information that is knowable about the physical system.
2) Every measurable quantity A (like position or momentum of a particle) is described by an
operator A that acts in the Hilbert space. 3) The only possible out come of a measurement of the quantity A is one of the eigenvalues of the
operator A . Hilbert Spaces A Hilbert space is just a fancy name for a linear vector space with certain properties. Vectors
wuv ,, ,… belong to a Hilbert space if and only if:
(1) For some operation, denoted by ‘ ’, the vector uv belongs to if v and u belong to
. (2) vuuv .
(3) wuvwuv .
(4) There is a ‘zero vector’ 0 such that vv 0 .
(5) For any v there exists a vector v such that 0 vv .
(6) For a complex number , v if v .
(7) For a complex number , uvuv .
(8) For complex numbers ,, vvv .
(9) The inner product of two vectors v and u , denoted by vu , has the following properties:
(a) *uvvu .
(b) 0vv , with equality if and only if 0v .
vv is called the magnitude of the vector.
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(10) An operator O acting in the Hilbert space has the property that for any vector v belonging
to vO, is also some vector belonging to .
Examples: There are many examples of Hilbert spaces besides the Hilbert space of quantum states. For example, the space spanned by 2-dimensional column vectors form a Hilbert space in which the vectors
are column vectors,
d
cu
b
av , ,… where ,...,,, dcba are complex numbers. The inner product
vu is
b
adc ** . The operators are 22 matrices
hg
fe.
Properties of Operators in Hilbert Space
Eigenvectors and Eigenvalues: A vector v is an eigenvector of an operator O if and only if
vvO ˆ and the complex number is called the eigenvalue corresponding to the eigenvector v .
In general, an operator O can have many eigenvalues ....,, 321 and the corresponding eigenvectors
are ,...,, 321 vvv i.e. kkk vvO ˆ .
Adjoint Operators: The adjoint operator O corresponding to O is defined by the following relation, *ˆˆ uOvvOu (1)
Let vOw ˆ . The left hand side in (1) is then wu . But (by property 9(a) of Hilbert spaces)
*uwwu . Comparing with right hand side of (1) we get Ovw ˆ . We can state the properties
of bra w corresponding to ket w ,
(a) if uvw then uvw ** .
(b) if vOw ˆ then Ovw ˆ .
Hermitian Operators: An operator O is Hermitian (or self-adjoint) if and only if OO ˆˆ . In quantum mechanics, operators corresponding to observables are always Hermitian since Hermitian operators have real eigenvalues. Basis Vectors Any set of vectors that belong to and ‘span’ (i.e. where any vector in can be written as a sum of vectors belonging to this set) is called a basis set. The minimum number of vectors in a basis set is called the dimentionality of . For example, if nvvvv ...,, 321 span an n-dimensional Hilbert space then
any other vector w in can be written as
n
kkk vaw
1. Usually basis sets are chosen such that all
vectors in it are mutually orthogonal. For example, for the Hilbert space of 2-dimensional column vectors
a basis set is
1
0,
0
1.
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Orthonormal Basis: In the expansion
n
kkk vaw
1 the expansion coefficients ja can be determined
by multiplying both sides with the bra jv ,
n
kkjkj
n
kkkjj
vvawv
vavwv
1
1
Since for orthogonal basis set 0kj vv unless kj ,
jj
jj
jjjj
vv
wva
vvawv
If the basis set is orthonormal then jkkj vv and in this case, wva jj .
Complete Basis: The completeness of an orthonormal basis set (i.e. the fact that the vectors in the set span the entire Hilbert space) is usually expressed as,
11
kn
kk vv (2)
Note that a combination of the form wu is actually an operator. To see this note that if wu acts on
any vector v one obtains vwvwu which is another vector, and this is a property of an
operator (property 10 of a Hilbert space). The operator 1 is the identity operator with the property that for
any vector vvv 1, (i.e. 1 does ‘nothing’). To see why for a complete basis kn
kk vv
1 equals
1 apply it to any vector w and see the result,
kn
kk
n
kkk
n
kkk
vwv
wvv
wvv
1
1
1
but, as found earlier, kk awv is the expansion coefficient when w is expressed in terms of the
orthonormal basis set,
n
k
n
kkkkk wvavwv
1 1
Thus, wwvvn
kkk
1
. Therefore, 11
n
kkk vv .
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The eigenvectors of a Hermitian operator can be chosen to be all orthogonal and they also form a complete set. 1.1.2 Postulate Four and Measurement of Physical Quantities in Quantum Mechanics Suppose A is an operator corresponding to a physical quantity A of a physical system. And suppose the quantum state vector of the physical system is (somehow) known. The question then is if A is
measured experimentally what would be the result? Postulate 3 tells us that the result can only be one of
the eigenvalues of the operator A . Suppose all the eigenvalues of A are known and the corresponding eigenvectors are also known, and they satisfy kkk vvA ˆ where .,...3,2,1 nk The question then is
which eigenvalue of A is going to be obtained upon measurement. The answer given by quantum mechanics is that one cannot know the result of a measurement before making the measurement but when
a measurement is made the probability for obtaining the result k is given by 2
kv . This is also a
postulate of quantum mechanics. Since the eigenvectors kv form a complete set one may expand as,
kn
kk va
1 where kk va
Just before the measurement, is in a ‘linear superposition’ of the eigenvectors of A . When a
measurement is made of the quantity A , the result k is obtained with probability
22 kk va .
The probabilities of all possible measurement outcomes must add up to unity, and this is easy to show. Start from 1 ,
2
11
1
1
1
n
kk
n
kkk
n
kkk
avv
vv
1.1.3 Postulate 5 and Collapse of the Quantum State upon Measurement Consider a physical observable A and the corresponding operator A , which has eigenvectors and
eigenvalues given by kkk vvA ˆ . The quantum state in terms of the eigenvectors of A is
assumed to be kk
k va . Suppose a measurement of A is made and the result j is obtained. The
question is what is the quantum state just after the measurement? The answer is not trivial. The quantum state of an object contains all the information that can be obtained about the object by making any kind of measurement. When some information has been obtained by making a measurement, the quantum state after the measurement must reflect this extraction of information. If the eigenvalue j was measured then
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the quantum state just after the measurement must be jv (i.e. the eigenvector corresponding to j ). If a
second measurement of A is made just after the first measurement then the result j will be obtained
with probability one, and this is certainly aesthetically pleasing. This sudden collapse of the quantum state
from k
kk va to jv upon measurement is called collapse of the quantum state and is a postulate of
quantum mechanics.
Case of Degenerate Eigenvalues: Suppose the first two eigenvalues of A are identical (i.e. 21
). The quantum state before the measurement of A is kk
k va . What is the quantum state after the
measurement if the result is obtained? In this case, since the measurement result cannot distinguish
between 1v and 2v , the quantum state after the measurement must lie in the eigen-subspace
corresponding to the eigenvalue , and is given as,
22
21
2211
aa
vava
In more technical language, the measurement projects the quantum state into the eigen-subspace corresponding to the measurement result. Mean Values of Operators The mean value of an operator A , with respect to a quantum state , is defined as the mean value of
the observable A obtained by making measurements of A on many identical copies of the quantum state
. If A has eigenvectors and eigenvalues given by, kkk vvA ˆ , and expressed in terms of
kv is k
kk va , then the probability of obtaining k is 2ka . Therefore, the mean value of A
with respect to the state is k
kka 2 . This can be written more generally as A or just A .
Some Common Observables
(1) Position of a Particle: The operator x corresponds to the position of a particle in 1 dimension. Eigenvectors of x are x with corresponding eigenvalues x (i.e. xxxx ˆ ).
Orthogonality relation: )'(' xxxx
Completeness relation: 1
xxdx
(2) Momentum of a Particle: The operator p corresponds to the momentum of a particle in 1
dimension. Eigenvectors of p are p with corresponding eigenvalues p (i.e. pppp ˆ )
Orthogonality relation: )'(' pppp
Completeness relation:
1ppdp
Wavefunction: Note that one can write that quantum state of a particle as,
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xxdxxxdx
1
The amplitude x is usually denoted by )(x and is called the wavefunction of the particle.
xx)(dx
Similarly,
ppp )(d
Question: What is xp ? We cannot answer this unless we know something more about the properties
of the operators x and p . The classical description of a particle is “quantized” by imposing (as a postulate) a commutation relation. For a non-relativistic, spin-less, particle this commutation relation is ipx ˆ,ˆ i.e. ixppx ˆˆˆˆ . One can obtain the value of the inner product xp from this
commutation relation, as shown below.
xpixpxp
ipx
ˆ,ˆ
ˆ,ˆ
xpxpxpxpi
xpixpxpxpxp
ˆˆ)(
ˆˆ
xppppxpxpxpxpxpi ˆ'''dˆˆ1ˆ)(
xppxxpxpxpxpxpi
xppxxxXpppxpxpi
xpppxppxpxpi
'''''''d'd)(
'''''dˆ''d)(
'''ˆ'd)(
The solution of the above integral equation can be found and it is,
2
xpi
exp
This is quite interesting; if xxx )(d and ppx )(d , then it follows that,
pe
dpppxdpxx
pxi
2
Similarly,
2)(d)(
xpi
exxp
It follows from the commutation relation that the coefficients of momentum and position basis expansion have a Fourier transform relationship!!
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It is also useful to know the action of the operators x and p on a state vector (i.e. what are the
states p and x ). We already know that )(xx . We need to find xx ˆ and px ˆ .
1) :ˆ xx
)(
ˆˆˆ ***
xxxx
xxxxxxxx
2) px ˆ :
A little more complicated,
x
x
i
pe
pxi
pe
ppppxpp
ppppxpxpx
pxi
pxi
)(
)(2
d
)(2
dd
dˆ1ˆˆ
Therefore, p acts like a differential operator in the position representation! 3) xp ˆ :
Proceed as before,
)()(2
d
)(dxdxˆ1ˆˆ
ppi
xxe
x
xxxpxxxpxpxp
pxi
x acts like a differential operator in the momentum representation. 4) :ˆ pp
)(
ˆˆˆ ***
pppp
pppppppp
Standard Deviation of Observables We saw earlier the expectation value, or the mean value, of an operator A is A . We will write
this mean value as A . What about the standard deviation? Define a new operator A as,
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AAAAA
AAA
ˆˆ2ˆˆˆ
ˆˆˆ
222
and,
222
22
222
ˆˆˆ
ˆˆ
ˆˆ2ˆˆˆ
AAA
AA
AAAAA
Heisenberg Uncertainty Relations Suppose we have two operators A and B . The Heisenberg Uncertainty Principle states that if
CiBA ˆ,ˆ (where C is some real number) then for all possible states the following relation holds,
4
ˆˆ2
22 CBA
Proof: For some real number , consider the state where BiA ˆˆ . Now we know
that 0 , therefore,
0ˆˆˆˆ BiABiA
Suppose A and B are Hermitian, then,
0ˆ,ˆˆˆ 222 BAiBA
But since iCBABA ˆ,ˆˆ,ˆ ,
0ˆˆ
0ˆˆ
222
222
CBA
CBA
The above must hold for all values of and this can only happen if,
4ˆA
0ˆˆ4
222
222
CB
BAC
Example: We know that ipx ˆ,ˆ , therefore,
4
ˆˆ2
22 px
This should not be a surprise since we already know that the position and momentum representations of a quantum state are related by,
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)(
2d)( pe
px
xpi
and this Fourier transform relationship implies that 4
ˆˆ2
22 px
The Hamiltonian Operator The energy of a particle of mass m and momentum p in a potential )(xV is given classically as,
xVm
pH
2
2
In quantum mechanics, the energy is given by the Hamiltonian operator H . For a free particle,
)ˆ(2
ˆˆ2
xVm
pH
1.1.4 Postulate 6 and Time Development in Quantum Mechanics The time evolution of a quantum state )(t is given by the Schrodinger equation (sixth postulate):
)(ˆ)( tHtt
i
This is a first order linear differential equation. Therefore, if )0( t is known, then using this as the
boundary condition )(t can be determined for all 0t . The formal solution of the above equation,
for a time independent Hamiltonian, is,
)0()(ˆ
tettH
i
Schrodinger’s wave equation also follows from the above equation by multiplying both sides with the bra x ,
ˆ( ) ( )x i t x H tt
If,
)ˆ(2
ˆˆ2
xVm
pH
then the Schrodinger equation gives,
22
2
ˆ( ) ( )
, ,,
2
x i t x H tt
x t x ti V x x t
t m x
which is a wave equation for the complex amplitude ,x t .
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Stationary States The eigenvectors of the energy operator H are called stationary states since they don’t evolve in time other than acquiring a time dependent phase factor.
Example: Suppose H has eigenvectors ke with eigenvalues k (i.e. kkk eeH ˆ ). Since H is
Hermitian, its eigenvectors form a complete set (i.e 1 kk
k ee ) and any arbitrary quantum state can
be expanded in terms of ke . Suppose k
kk ect )0( . Assume, k
kk etct )( , and plug
in the Schrodinger equation,
)(ˆ)( tHtt
i
kkkk
kkk
kk
k etceHtcet
tci ˆ
Multiply by bra je on both sides to get,
)()(
tct
tci jj
i
Solution is,
t
i
j
ti
jj
jj
ecetctc
0)(
kk
ti
kkk
k eecetctk
)()(
This implies 22
)0()( tete jj for all times. The probability of being in particular energy
eigenstate does not change with time. That is why energy eigenstates are called stationary states. Matrix Representation of Operators Suppose vectors k form a complete set ( i.e. 1
kkk ). Any operator can be written as.
kjjkjk
k jjjkk
A
A
AA
ˆ
ˆ
1ˆ1ˆ
Let, jkkj AA ˆ . Then,
jkkj
kjAA ˆ
We can represent A in matrix form by choosing a mapping between basis vectors k and column
vectors. For example, let,
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.....1
0
0
0
1
0
0
0
1
321
The operator A is then a matrix,
2221
1211 ....ˆ AA
AA
A
If the basis set chosen consists of eigenvectors of A then jjkjjkkj AAA ˆ and in this basis set
the operator A is represented by a diagonal matrix,
0
0
00
ˆ 22
11
A
A
A
Hamiltonian Operator in a Different Form We know that for a particle in a potential,
)ˆ(2
ˆˆ2
xVm
pH
Suppose H has eigenvectors ke with eigenvalues k (i.e. kkk eeH ˆ ). Using these energy
eigenvectors, we can write H in a different form,
kkkk
j kjjkjk
jjj k
jkk
jj
jk
kk
eeH
ee
eeee
eeHee
HH
ˆ
ˆ
1ˆ1ˆ
Now suppose we have a Hamiltonian oH ,
)ˆ(2
ˆˆ2
xVm
pHo
and we found the eigenvectors ke and eigenvalues k (i e. kkko eeH ˆ ). Now suppose an
additional potential xU ˆ is added to oH so that the full Hamiltonian is now H , where,
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jkkj
kj
k jkkjkkk
jj
jok
kk
o
o
exUeUeeUeeH
eexUHee
xUHHH
xUxVm
pxUHH
ˆˆ
)ˆ(ˆ
1))ˆ(ˆ(11ˆ1ˆ
)ˆ()ˆ(2
ˆ)ˆ(ˆˆ
2
The first part is `diagonal’ in the basis used. The second part is not diagonal.
1.2 Dynamics of a Two-Level System
Suppose oH has only two important eigenvectors; 1e and 2e which are degenerate, i.e.,
2211ˆ eeeeHo
Suppose a small potential is added to the Hamiltonian such that,
0
)ˆ(ˆˆ
2211
211212212211 UU
UUUeeUeeUeeee
xUHH o
Physical Realization: A coupled quantum well system, shown below, is a two-level system. oH
corresponds to the Hamiltonian when the two potential wells were very far apart, and H corresponds to the Hamiltonian when the two wells are close enough to be coupled via tunneling through the potential
barrier. This coupling is described by the additional off-diagonal terms in the Hamiltonian H .
Suppose at time 0t the particle is placed in well #1 so that 1)0( et . We need to find the
particle wavefunction for 0t . Solution by Expansion in the Original Eigenstates: Assume the following solution for 0t ,
2211 )()()( etcetct
d
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with the boundary condition 1)0(1 tc and 0)0(2 tc ) and plug into the Schrodinger equation to get,
22112211 )()(ˆ)()( etcetcHetcetct
i
Multiply by the bras 1e and then 2e to get two equations,
)()()(
)()()(
122
211
tcUtctct
i
tcUtctct
i
The matrix form of the above two equations is,
)(
)(
)(
)(
2
1
2
1
tc
tc
U
U
tc
tc
ti
Solution, subject to the initial conditions, is,
Uteitc
Utetc
ti
ti
sin)(
cos)(
2
1
and,
.sin)()(
.cos)()(
222
22
221
21
Ut
tcte
Uttcte
The quantum state oscillates in time between 1e and 2e .
Solution by Expansion in the Exact Eigenstates: Start from,
12212211
)ˆ(ˆˆ
eeUeeUeeee
xUHH o
We can diagonalize the new Hamiltonian. In matrix representation, where
0
11e and
1
02e , H
is,
U
UH
Eigenvalues of H are U and U and the corresponding eigenvectors are
1
1
2
1 and
1
1
2
1,
respectively, which correspond to states, 212
1ee and 21
2
1ee , respectively. Let these
states be 1v and 2v , respectively. We can work out temporal dynamics using 1v , 2v which are
the eigenvectors of the full Hamiltonian. The initial state is,
2112
1)0( vvet
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Since 1v and 2v are the energy eigenstates, they are stationary states. So using the earlier result, the
state at a later time is,
2
)(
1
)(
ˆ
2
1)(
)0()(
vevet
tet
tUi
tUi
tHi
It follows that,
2
1)0()(
2
1)0()(
22
22
21
21
tvtv
tvtv
But now if we evaluate 2
1 )(te we get,
Ut
tvvte 22
212
1 cos)(2
1)( .
and similarly,
Ut
te 222 sin)(
which are the same results obtained earlier via a different method.
1.3 Fermi’s Golden Rule Now consider the problem of one level coupled with infinitely many levels, as shown below.
The Hamiltonian can be written as,
100
1000
ˆk
kkkkkk
kk eeUeeUeeeeH
The levels 1 to are described by a density of levels (or density of states) )(ED that has units equal to the number of levels per unit energy interval, and can be written as,
1)(
kkEED
One cannot diagonalize this giant Hamiltonian. Suppose 0)0( et , then one may ask the question:
what is the escape time of the particle from the well? As before, let the solution be of the form,
100 )()()(
kkk etcetct
And plug this solution in the Schrodinger equation to get the following equations,
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
18
)()()(
)()()(
0
1000
tcUtctct
i
tcUtctct
i
kkkk
kkk
The initial conditions are,
,3,2,100
1)0(0
ktc
tc
k
Suppose,
ti
kk
ti
k
o
etctb
etctb
)()(
)(00
This gives us,
tt
i
kk
ti
kk
kk
ti
k
tdetbUi
tb
etbUt
tbi
tbeUt
tb
k
k
k
0
)(
0
)(
0
1
)(0
0
0
0
)'()(
)()(
)()(
Use this expression in the equation for )(0 tb to get,
t tti
kk tbetdU
t
tb k
00
)()(2
120 )'(
1)( 0
Note the following correspondence for any function A,
1
kk
A dE D E A E
So we can write the integral above as,
0
0
0
( )( )20
020
( )( )2
020
( )( )2
0 0 020
2
( ) 1( ')
1 ( ')
1 ( ')
1
Et i t t
Et i t t
Et i t t
b tdE D E U E dt e b t
t
dt dE D E U E e b t
D U dt dE e b t
D
20 0 0
0
20 0 0
0
2 ' ( ')
( )
( )2
tU dt t t b t
D U b t
b t
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
19
The above equations shows that the probability of finding the particle at any later time to be in the initial state decays as,
2
0
20 )(
)(tb
t
tb
where the decay rate is,
10
2)(
2
kkkU
If we replace the summation
1k by the integral EdE D , and 2
kU by 2EU , then we
get,
)()(2
2
02
0
02
DU
EEUEDdE
The above relation is called Fermi’s Golden Rule. Conclusion: When the number of possible final states is infinite, there are no oscillations. There is just a decay of the initial state into the final states and the decay rate is given by the Fermi’s Golden Rule.
1.4 Heisenberg and Schrodinger Pictures in Quantum Mechanics 1.4.1 The Schrodinger Picture In quantum mechanics, one is usually interested in calculating expectation values of operators, e.g. quantities like )(ˆ)( tAt . The calculation proceeds as follows:
i) Given the initial state )0( t , calculate )(t for 0t using the Schrodinger equation,
)(ˆ)( tHtt
i
The formal solution is )0()(
ˆ
tet
tHi
. The operator exponential is to be interpreted as its
Taylor series expansion, i.e.,
22
2ˆ
2
ˆˆ1 t
HtH
ie
tHi
ii) Once )(t is known, calculate )(ˆ)( tAt .
This method, which we have been using so far, is called the Schrodinger’s picture. In the Schrodinger picture, the state vectors are time dependent and the operators are time independent. 1.4.2 The Heisenberg Picture There is another equivalent way to calculate expectation values of operators. First note that,
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
20
)0(ˆ)0()(ˆ)(
ˆˆ
teAettAtt
Hit
Hi
If one defines a time-dependent operator )(ˆ tA as,
t
Hit
Hi
eAetA
ˆˆ
ˆ)(ˆ
then )(ˆ)( tAt becomes )0()(ˆ)0( ttAt . In this new form, the quantum state does not
change with time but the operator evolves in time. This is called the Heisenberg picture. In the Heisenberg picture the operators are time dependent,
t
Hit
Hi
eAetA
ˆˆ
ˆ)(ˆ
One can differentiate both sides with respect to time to get,
HtAdt
tAdi ˆ),(ˆ
)(ˆ
The above equation is called the Heisenberg equation. The calculation procedure in the Heisenberg picture is as follows:
i) Given an initial state )0( t and an operator A , calculate )(ˆ tA using the Heisenberg equation,
HtAdt
tAdi ˆ),(ˆ
)(ˆ
with AtA ˆ)0(ˆ as the boundary condition.
ii) Once )(ˆ tA is known, the mean value of A at time t is obtained as follows,
)(ˆ)0()(ˆ)0()(ˆ)( tAttAttAt
In the Heisenberg picture, the operators are time dependent and the state vectors are time independent (one just uses the initial state for calculations). Note that:
(a) HeHetHt
Hit
Hi
ˆˆ)(ˆˆˆ
, the Hamiltonian operator is time-independent.
(b) If CBA ˆˆ,ˆ then the equal time commutation relation at a later time is,
)(ˆˆˆˆˆˆ)(ˆ),(ˆˆˆˆˆ
tCeCeeABBAetBtAt
Hit
Hit
Hit
Hi
The form of the equal-time commutation relations do not change with time. The equal-time commutation relations represent fundamental properties of physical systems and their form are time independent. A Two-Level System in the Heisenberg Picture The two-level system discussed earlier is described by the Hamiltonian, 12212211
ˆ eeUeeUeeeeH
Suppose, 1)0( et . We need to find 2
1 )(te and 2
2 )(te using the Heisenberg picture.
We define the following number operators, 222111
ˆˆ eeNeeN
Then the desired quantities can be written as,
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
21
.)0()(ˆ)0()(
)0()(ˆ)0()(ˆ)()(
22
2
112
1
ttNtte
ttNttNtte
So we need to find )(ˆ1 tN and )(ˆ
2 tN . We also define operators and as,
ˆˆˆˆ 1221 eeee
H is then,
ˆˆˆˆˆ21 UNNH
You can verify that the following commutation relations hold,
12
21
21
ˆˆˆ,ˆ
ˆˆ,ˆˆˆ,ˆ
ˆˆ,ˆˆˆ,ˆ
NN
NN
NN
Using the Heisenberg equation we get,
dt
tditNtNUHt
dt
tdi
dt
tNdittUHtN
dt
tNdi
ˆ)(ˆ)(ˆˆ),(ˆ
)(ˆ
ˆ)(ˆ)(ˆˆ),(ˆ)(ˆ
12
21
1
Note that,
212121ˆˆ)(ˆ)(ˆ0)(ˆ)(ˆ NNtNtNtNtN
dt
d
Define, )(ˆ)(ˆ)(ˆ12 tNtNtNd . The equation for )(ˆ tNd is,
)(ˆ4)(ˆ
2
22tN
U
dt
tNdd
d
The above equation can be solved with the two boundary conditions,
ˆˆ2)(ˆ
ˆˆˆ)0(ˆ
012
iU
dt
tNdNNNtN
t
ddd
Solution is,
t
Uit
UNtN dd
2sinˆˆ
2cosˆ)(ˆ
It follows that,
tUi
tU
NtU
N
tNNNtNtNtNtN dd
2
sinˆˆ2
sinˆcosˆ
2
)(ˆˆˆ
2
)(ˆ)(ˆ)(ˆ)(ˆ
22
21
21211
and
UtiUt
NUt
NtN2
sinˆˆ2
cosˆsinˆ)(ˆ 22
212
The above two operator expressions for )(ˆ1 tN and )(ˆ
2 tN might look strange. The answer for the
Heisenberg operators )(ˆ1 tN and )(ˆ
2 tN has been expressed in terms of the Schrodinger operators 1N , 2N
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
22
, , and , and we already know the action of these Schrodinger operators on the quantum states. We can now obtain,
.cos
)(ˆ
)0()(ˆ)0()(
2
11
12
1
Ut
etNe
ttNtte
and,
.sin)(ˆ)( 2121
22
tU
etNete
These results are the same as found earlier using the Schrodinger equation.
1.5 Quantum Mechanical Measurements 1.5.1 Commutation Relations in Quantum Mechanics and Physical Measurements In quantum mechanics, commutation relations have an intimate connection with physical measurements and this connection will be explored in the following Sections. Commutation Relations and Common Eigenvectors We know from linear algebra that if two matrices commute then they can both have the same set of
eigenvectors. In quantum mechanics, if two operators A and B commute (i.e 0ˆ,ˆ BA ) then they also can have the same set of eigenvectors.
Outline of the Proof: Suppose A has eigenvector kv with eigenvalues k i.e kkk vvA ˆ . Since
0ˆ,ˆ BA ,
kkk
kkk
k
vBvBA
vBvBA
vABBA
ABBA
ˆˆˆ
0ˆˆˆ
0ˆˆˆˆ
0ˆˆˆˆ
kvB is also an eigenvector of A with eigenvalue k . If A has all distinct eigenvalues then kvB
must be proportional to kv (i.e kk vvB ˆ ) and this means that kv is also an eigenvector of B . If
A has many eigenvectors with the same eigenvalue k then kvB must at least lie in this
eigensubspace of A even if kvB is not proportional to kv . In this case, the vectors in this
eigensubspace of A can be chosen such that they are also eigenvectors of B (a proof of this can be found in any text on linear algebra). Commutation Relations and Simultaneous Measurements Consider two operators A and B that have eigenvectors and (all distinct) eigenvalues given by,
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
23
kkkkkk uuBvvA ˆˆ
1) Supppose the observableA is measured for a state . The a-priori probability of obtaining the result
k is 2
kv . Suppose j was obtained. Immediately after the measurement the quantum state
collapses to jv . All subsequent measurements of A (done fast enough so that no evolution described
by the Schrodinger equation takes place during this time) will yield the result j .
2) Now suppose the observableA is measured for a state . Suppose j was obtained and
immediately after this measurement the quantum state collapsed to jv . Now suppose the
observableB is measured. The a-priori probability of obtaining k is 2
jk vu . Suppose j was
obtained. Immediately after the measurement the quantum state jv collapses to ju . If now A is
again measured, the probability of obtaining k is 2
jk uv . The measurement of B `disturbed’ the
quantum state so that the second measurement of A gave a different result than the first. We say that A and B are not simultaneously measurable. Measurement of one quantity disturbs the value of the other quantity.
3) Suppose 0ˆ,ˆ BA . Then A and B have the same set of eigenvectors, say k . In other words,
kkkA ˆ
kkkB ˆ
Now suppose the following sequence of events: A is measured result j is obtained B is
measured result j obtained. But now all subsequent measurements of A and/or B will give the
results j and j , respectively. We say that if A and B commute they are simultaneously measurable
(i.e. measurement of one quantity does not disturb the value of the other quantity). Of course, it has been implicitly assumed that all measurements are done in a time period short enough that no time evolution of the quantum state occurs. 1.5.2 Quantum Mechanical Decoherence Decoherence is one of the least understood as well as the most misunderstood concept in quantum mechanics. A simple picture of decoherence is presented here. Consider the superposition state
2211 vcvc of a particle. A measurement is made to determine whether the particle is in 1v
or 2v . If the result is 1v and the state immediately after the measurement is 1v (i.e. 1v ). If
the result is 2v then just after the measurement, 2v . In either case, the action of measurement
destroys the linear superposition state given by 2211 vcvc and replaces it by either 1v or 2v
depending upon the measurement outcome. In other words, the acquisition of information (by intelligent beings) can destroy quantum mechanical linear superpositions. An intelligent being does not need to make a direct measurement. He/she can perhaps use, say a photon or phonon, and scatter it off the particle
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
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to determine whether the particle is in 1v state or in 2v state. Any such procedure that gives the
intelligent being information about whether the particle is in 1v or 2v destroys the linear
superposition and collapses the quantum state of the particle into either 1v or 2v .
Now suppose the test particle is interacting with its environment. If there is a way by which an intelligent being can determine whether the particle is in 1v or 2v by just observing the environment then the
linear superposition state of the particle will still get destroyed. Linear superpositions can therefore be short lived and can easily get destroyed by interaction with the environment (even if no intelligent being is actively making a measurement). A question to ask here is if there a way to quantify this destruction of quantum mechanical linear
superpositions. For the state 2211 vcvc , consider the products 21cc and 12cc
. These
products are indicative of the linear superposition in the state . If these products are zero then a linear
superposition does not exist. The operators 21ˆ vv and 12ˆ vv generate these products
given a state ,
1221 ˆˆ cccc
The interaction of a particle with its environment can make these products go to zero as time progresses, i.e.,
0)()()(ˆ)( 21
ttctctt
and,
0)()()(ˆ)( 12
ttctctt
This phenomenon which results in the destruction of quantum mechanical superpositions is called quantum mechanical decoherence. A Paradox: We started from a state 2211 vcvc and reached the conclusion that as time
progresses, will either collapse into 1v or 2v by interaction with the environment (i.e. the linear
superposition will get destroyed). Suppose a new basis set is introduced,
21212
1
2
1vvvvvv
Then starting from 2211 vcvc one ends up in 1v or 2v which one can also write as,
vv2
1 and vv
2
1, respectively. We said linear superpositions get destroyed by
interaction with the environment. Then now come we end up in linear superposition states after interaction with the environment? Of course, any state can be written as a linear superposition state by choosing an appropriate basis set. Whether or not linear superpositions in a particular basis representation get destroyed depends on the nature of the interaction between the particle and the environment and exactly what information is extracted by the environment during the interaction. Suppose the interaction of the particle, initially in state 2211 vcvc , is such that an intelligent observer by looking
later at the environment can figure out whether the particle was in v or v . We can write as,
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vcc
vcc
vcvc22
21212211
As time progresses the linear superposition between v and v will get destroyed and the particle
state will end up in v or v , which are 212
1vv and 21
2
1vv , respectively.
1.6 The Quantum Mechanical Density Operator 1.6.1 Pure States and Statistical Mixtures Consider two sets of quantum states: Set A: A large number of identical copies of the linear superposition state, 2211 vcvc
Set B: A large number of states 1v and 2v . The numbers of 1v states and 2v states are in the
ratio 22
21 : cc .
Set A consists of pure states . Set B is a statistical mixture of states 1v and 2v . Suppose the states
21 , vv are eigenstates of an operator O with corresponding eigenvalues 1 and 2 , respectively. If
the mean value of O is measured for sets A and B, the same result
2
222
11 cc will be obtained
for both sets. Is there a way to handle the distinction between pure states (set A) and a statistical mixture (set B)? The answer is yes, and the density operator is the tool designed to handle pure states and statistical mixtures on equal footing. 1.6.2 The Density Operator and the Density Matrix in Quantum Mechanics Density operators are a useful way to represent quantum states. Density operators can also describe dynamics of quantum states (including decoherence) in a simple way. Density operators can also represent statistical mixtures in addition to pure quantum states. Most generally, a quantum state is not represented by a state vector , but by a density operator .
For a pure state the density operator is . If 2211 vcvc , as in the case of set A
above, is,
21121221222
2112
1ˆ vvccvvccvvcvvc
The density operator, like all quantum mechanical operators, can be put in a matrix form. In matrix
representation, using the basis 1v and 2v (i.e. 101 v and 0
12 v ), the density operator is,
2221
122
1ˆccc
ccc (1)
The diagonal elements of indicate the occupation probabilities, and the off-diagonal elements represent coherences. For a statistical mixture, as in the case of set B above, the density operator is,
222
2112
1ˆ vvcvvc
In matrix form,
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22
21
0
0ˆ
c
c (2)
Comparing (2) to (1), we see that the off-diagonal elements of the density matrix are absent for a statistical mixture. We also know that decoherence can destroy linear superposition and reduce a large collection of states of the form 2211 vcvc to a statistical mixture that has states 1v and 2v with
probabities 21c and 2
2c . Thus we expect,
22
21
2221
122
1
0
0ˆˆ
c
c
ccc
ccc eDecoherenc
Decoherence can destroy off diagonal elements of the density operator (or the density matrix). Mean Values of Operators Using the Density Operator/Matrix: The mean value of an observable A
with respect to the state was AA ˆˆ . The mean value of A with respect to the density
operator is defined as,
AA ˆˆˆ Trace
Suppose, ˆ where 2211 vcvc , and 1v and 2v form a complete basis. Then,
A
vAvccvAvcc
vAvcvAvc
vAvvAv
vAvAn
nn
ˆ
ˆˆ
ˆˆ
ˆˆ
ˆˆ
211211212
222
2112
1
2211
Trace
On the other hand if represents a statistical mixture of 1v and 2v with probabilities 21c and 2
2c
then,
222
2112
1
222
2112
1
ˆ
ˆˆˆˆ
vAvcvAvc
AvvcvvcAA
TraceTrace
A More Complicated Example: Suppose we have a statistical mixture of states 212
1vvv
and 212
1vvv with probabilities p and p , respectively. In this case we have a statistical
mixture of linear superposition states. Then, 1ˆ ppvvpvvp
We can write the above expression as,
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27
12212211
12212211
12212211
222
1
2
1
2
2 ˆ
vvpp
vvpp
vvvv
vvvvvvvvp
vvvvvvvvp
Note that the density matrix was diagonal in the vv , basis but has off-diagonal elements in the
21 , vv basis. The average value of the observable A is then,
.ˆ
2ˆ
2
ˆ2
1ˆ2
1ˆˆˆ
2112
2211
vAvpp
vAvpp
vAvvAvAA
Trace
The above examples show that density operators/matrices can handle the most general types of situations. 1.6.3 Time Development of Density Operators In the case of pure states, the average value of a quantity A at time “t” was shown to be,
dependent) timeisoperator (the PictureHeisenberg
dependent) timeis state (the PicturerSchrodinge
0ˆ0
ˆˆ
ttAt
tAttA
There are also two ways to calculate averages when quantum states are described by density operators,
dependent) timeisoperator (the PictureHeisenbergTrace
dependent) timeis state (the PicturerSchrodingeTraceTrace
tAt
AttAttA
ˆ0ˆ
ˆˆ0ˆˆˆ
To see their equivalence, recall that,
t
Hit
Hi
eAetA
ˆˆ
ˆˆ
So,
tHit
Hi
eAettAt
ˆˆ
ˆ0ˆˆ0ˆ TraceTrace
Use the result, ABBA ˆˆˆˆ TraceTrace , to get,
At
AetetAtt
Hit
Hi
ˆˆ
ˆ0ˆˆ0ˆ
ˆˆ
Trace
TraceTrace
where,
t
Hit
Hi
etet
ˆˆ
0ˆˆ
After differentiating the above equation with respect to time we obtain the Schrodinger equation (not the Heisenberg equation) for the density operator,
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
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tHt
ti
ˆ,ˆˆ
Note that the above equation is a little different from the Heisenberg equation for any other operator,
HtAt
tAi ˆ,ˆ
ˆ
An advantage of the Heisenberg picture is that we can calculate correlation functions of observables, such as,
21ˆˆ0ˆ tBtAt Trace
It is difficult to compute these quantities in the Schrodinger picture. In the Schrodinger picture, we can only easily compute equal time averages, e.g.,
BAttBtAt ˆˆˆˆ0ˆ 111 TraceTrace
Two-level System via the Density Operator Formalism in the Schrodinger Picture Consider the two-level system described by the Hamiltonian, .ˆ
21122211 eeeeUeeeeH
Suppose, 10 et . The density operator is then,
11000ˆ eettt
In the matrix form, with 101 e and 0
12 e as the basis, we get,
00
010ˆ t
Our goal is to find,
teetteette 1111112
1 ˆ Trace
Start from,
tt
ttHttH
t
ti t
2221
1211ˆˆˆˆˆˆ
Take the matrix element of the above equation with 1e and 1e to get,
ttUtdt
di 211211
Take the matrix element with 2e and 1e to get,
ttUtt
i 112221d
d
Similarly,
ttUtdt
di
ttUtdt
di
112212
211222
Note that,
000
0
1122112211
2211
ttttt
ttdt
d
The above equation described the conservation of probability during time evolution. Let,
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29
ttt
ttt
s
d
2112
1122
Then,
tiUt
dt
dsd
2
and,
tiUt
dt
dds
2
Combining the above two equation gives,
tUt
dt
ddd
2
2
2 2
The boundary conditions are,
00
20
2
1000
21120
1122
ttiU
tiU
tdt
d
ttt
st
d
d
The solution is,
.Ut
t
.Ut
tU
tρttt
.tU
t
d
d
222
2221111
sin
cos2
2cos1
2
2cos
So,
.cosˆ 21111
21
tU
teette
rT
This is the same result as obtained earlier by different methods. Decoherence in the Density Operator Formalism We first discuss the effects of decoherence. Averages computed via the density operator should be
interpreted is an average sense, i.e. the average AttA ˆˆˆ Trace could mean either one of the
following: a) Several identical copies of a system are prepared at 0t and the state of each system is
represented by the density operator 0ˆ t . At time t measurement of a quantity A is made on all copies of the system. The average of the results obtained corresponds to the
quantity At ˆTrace .
b) A single system is prepared at 0t and the state of the system is represented by the density operator 0ˆ t . At time t measurement of a quantity A is made. The system is then put
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
30
(by some means) in the same state 0ˆ t , and the process is repeated many times. The
average of all the measurements corresponds to the quantity At ˆTrace . We are now in a position to understand how decoherence will effect our results. Suppose we have N different copies of a two-level system, and all copies are prepared in the state 1e at time 0t . So,
assuming interpretation (a), the density operator of each system is, 110ˆ eet
At later time t (assuming no decoherence),
2112
222
112
sincossincos
sincos
ˆ
eeUtUt
ieeUtUt
i
eeUt
eeUt
ttt
At time t consider the state of the j -th system,
ti
jjjee
Utie
Utt
21 sincos
Suppose the j -th system at 1tt collapsed into 1e as a result of decoherence. For 1tt , j
t
becomes,
1
1
21
2111
sincos
sincos
tti
jjjj
tti
jjj
eeUt
ieUt
eettU
iettU
t
where,
1Utj . Now suppose at 2tt the k -th system collapsed into 2ei . For 2tt ,
2
21 2sin
2cos
tti
kkkkkee
Utie
Utt
where
2Utk . As time progresses more and more systems will decohere and collapse into either
2ei or 1e . Since the times when the states of different systems collapse are random, the phases
will also be random. Therefore, in what follows, one can absorb the 2
phase terms in it. The process of
decoherence usually has an associated time scale, which we will call 1 . For 1t , most systems
will not have experienced a state collapse. For 1t , most systems would have experienced a state
collapse. At time t , the ensemble average of any observable quantity A (averaged over the entire system) will be,
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
31
pppp
pppp
pppp
N
ppp
N
ppp
eAeUtUt
i
eAeUtUt
i
eAeUt
eAeUt
N
N
tAt
tA
12
21
222
11
12
1
ˆsincos
ˆsincos
ˆsinˆcos1
ˆ
ˆ
If 1t , p for every system will be non-zero and will have a random value. For N large, one can
replace the sum over p by averaging with respect to assuming that is a random variable uniformly
distributed in the interval from 20 , and the above expression becomes,
2211
1221
2
022
211
2
ˆ2
1ˆ2
1
ˆ22sin2
1ˆ22sin2
1
ˆsinˆcos2
1ˆ
eAeeAe
eAeUt
ieAeUt
i
eAeUt
eAeUt
tA
d
The above result is equivalent to the density matrix t for 1t given by,
2
10
02
1
1ˆ t
A description of decoherence must therefore give the same results as obtained above. This can be done by modifying the equations for the off-diagonal components of the density matrix and introducing a decay term,
ttUitt
dt
d
ttUitt
dt
d
11222121
11221212
Now we get for, tttd 1122 the equation,
02d
2
2
2
tU
tdt
tdt
dddd
Using the same boundary conditions as before we get the result,
22
2
2
2
sin2
cos
U
ttett
d
and,
Quantum Optics for Photonics and Optoelectronics (Farhan Rana, Cornell University)
32
ttet
ttet
t
t
sin2
cos12
1
sin2
cos12
1
222
211
As t ,
2
12
1
22
11
t
t
and,
0
0
21
12
t
t
Therefore,
2
10
02
1
ˆt
tp
This is just what was desired. Thus, introduction of coherence decay terms (i.e. ) works as expected.
Note that we arbitrarily inserted these coherence decay terms in the equations for t12 and t21 .
Question arises if there is a better description, or a better equation, for the density operator of the form,
??ˆd
dt
ti
whose matrix elements contain the decoherence terms for the off-diagonal components. It terms out there is such an equation, but it is complicated. It is much easier to do this is the Heisenberg picture using Langevin equations. We shall do this later in the course. Two-level System via the Density Operator Formalism in the Heisenberg Picture In the Heisenberg picture,
tAttA ˆ0ˆˆ Tr
where,
tHtAtAt
i ˆ,ˆˆd
d
We have as before,
ttUtNt ˆˆˆ
d
d1 (1)
ttUtNt
i
ˆˆˆd
d2 (2)
tNtNUtt
i 12ˆˆˆ
d
d (3)
tNtNUtt
i 12ˆˆˆ
d
d (4)
Since,
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33
ttpt
ttptpt
tNtpt
tNtp
Ntp
eetpt
ˆ0ˆ
ˆ0ˆˆˆ
ˆ0ˆ
ˆ0ˆ
ˆˆ
ˆ
21
12
222
1
1
1111
Trace
TraceTrace
Trace
Trace
Trace
Trace
the average of equations (1)-(4) with respect to 0ˆ tTrace gives the equations we obtained
earlier for tttt 21122211 ,,, and working in the Schrodinger picture. The solution of (1)-(4) is,
.sinˆ
cosˆ
ˆˆ0ˆˆ
2sinˆˆ
2
1sinˆcosˆˆ
22
2111
11111
22
211
UttN
UtetNe
tNeetNttN
Uti
UtN
UtNtN
TraceTrace
Now we want to introduce decoherence. We can try changing the equations for t and t as follows,
tNtNUitt
dt
d12
ˆˆˆˆ (5)
tNtNUitt
dt
d12
ˆˆˆˆ (6)
The motivation for adding these decay terms is that we know that, ttttt 12ˆˆˆ0ˆ TraceTrace and, ttt 21ˆ0ˆ Trace
Since we have already seen that the equations for t12 and t21 and know they have the decay
terms, the modified equations for t and t ensure that we get the right equations for t12 and
t21 . The solution of (1) (2) (5) (6) with initial conditions,
ˆ0ˆˆ0ˆ
0ˆˆ0ˆ2211
tt
NtNNtN
is
22
22211
2
2sinˆˆ
sin2
cos12
ˆsin
2cos1
2
ˆˆ
U
teUi
tteN
tteN
tN
t
tt
and,
tNtN 12ˆ1ˆ
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Finally,
tte
etNetNeetNttN
tsin
2cos1
2
1
ˆˆˆ0ˆˆ
2
11111111
TrTr
which is the same result as before. A Big Problem: We had said earlier that time evolution in the Heisenberg picture preserves the commutation relations between operators.
Proof: If CBA ˆˆ,ˆ then,
tCeCeeBAetBtAtH
itH
itH
itH
i
ˆˆˆ,ˆˆ,ˆˆˆˆˆ
Commutation relations are fundamental ingredients of the quantum mechanical description of any system and can never be violated. But if one adds extra terms to the right hand side of the Heisenberg equation,
HtAdt
tAdi ˆ,ˆ
ˆ
then there is no guarantee that the commutation of tA with other operators will be preserved during
time evolution. For example, to model decoherence we changed the equation for t given by,
tNtNUi
Hti
tdt
d12
ˆˆˆ,ˆˆ
to,
12ˆˆˆˆ,ˆˆˆ NtNU
itHt
itt
dt
d
The original equation preserved the commutation relations, such as,
tttN ˆˆ,ˆ1
The modified equation does not preserve such commutations In modeling decoherence, we changed the equations in a way that spoiled the quantum mechanical consistency of the equations. We did not detect this problem in the Schrodinger picture since we took averages of the density operator equation,
1221
2112
2222
1111
ˆ
ˆ
ˆ
ˆ
etet
etet
etet
etet
and introduced decoherence into not the operator equations but the equations for complex numbers (e.g. t21 and t12 ). Later in the course, we will see that decoherence introduces noise into the system
that is in some sense fundamental. This noise will be studied with Heisenberg-Langevin equations.
1.7 Product Hilbert Spaces The Hilbert space of two independent quantum systems is obtained by “sticking” together the Hilbert spaces of the individual systems. For example, consider two systems, system “a” and system “b”, with quantum states
a and
bx , respectively. The state of the combined system is written as,
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35
ba
x
An operator in this enlarged Hilbert space is written as a tensor product, BA ˆˆ , where the operator A (or
B ) acts only in the Hilbert space of system “a” (or system “b”) as follows,
baba
BABABA ˆˆˆˆˆˆ
Example: Two Different Two-Level Systems:
The Hamiltonian for two different two-level systems is,
baba HHH ˆ11ˆˆ which, with a slight abuse of notation, is more commonly written as,
bHHH ˆˆ ˆa
Here,
122111
122111
ˆ
ˆ
eeeeH
eeeeH
bbbbb
aaaaa
An eigenstate of the combined system is, for example,
baee 21
And the action of the Hamiltonian on the eigenstate is,
ba
baba
bbaabbaa
bababababa
ee
eeee
eHeeeH
eeHeeHeeH
2121
212211
2121
212121
ˆ11ˆ
ˆ11ˆˆ
Note that each operator in the tensor product acts on the state belonging to its own Hilbert space. Example: Two Different Radiation Modes in a Cavity The Hamiltonian for two different modes (“1” and “2”) of radiation in a cavity is,
222111212121 ˆˆˆˆˆˆˆ11ˆˆ aaaaHHHHH
Eigenstates of the above Hamiltonian are of the form,
21mn
2111
221211
212121
ˆˆ
ˆˆˆ
mnmn
mHnmnH
mnHHmnH
1.8 Entangled States
1
1
a b
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1.8.1 Introduction States belonging to a combined Hilbert space of two systems, “a” and “b”, are of two types:
1) Unentangled states 2) Entangled states
States of the type ba
x that can be written as,
ba
b"systemofstateuniqueaa"systemofstateuniquea ""
are unentangled states. Examples of unentangled states for two different two-level systems are,
bbaa
bababba
bababaa
ba
eeee
eeeeeee
eeeeeee
ee
2121
2111211
1211121
21
2
1
2
1
2
1
2
1
2
1
2
1
iv)
iii)
ii)
i)
For entangled states, this “separation” is not possible. For example, consider the entangled state,
baba
eeee 12212
1
The state above cannot be written in the form, ba
x .
1.8.2 Entangled States and Quantum Measurements Entangled states have some interesting consequences when it comes to measurements. First, consider the complicated un-entangled state of two different two-level systems,
bbaaeeee 2121
2
1
2
1
2
3
Suppose we measure the energy of system “b”. Possible outcomes and the corresponding probabilities are,
2
1
1
yprobabilit
2
1yprobabilit
2
Suppose we measure the energy of system “a”. Possible outcomes and the corresponding probabilities are,
4
1
1
yprobabilit
4
3yprobabilit
2
Now suppose we made an energy measurement on system “a” and obtained the result 1 . Right after this measurement the state of the full system is,
bbaeee 211
2
1.
If after the measurement on system “a”, we make a measurement on system “b”, the possible outcomes and the corresponding associated probabilities are,
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37
2
1
1
yprobabilit
2
1yprobabilit
2
Therefore, measurement on system “a” has not changed the measurement results (i.e possible outcomes and the corresponding probabilities) for system “b”. Now consider the entangled state,
baba
eeee 1221 2
1
2
3
For energy measurement on system “a”, possible outcomes and the corresponding probabilities are,
4
1
1
yprobabilit
4
3yprobabilit
2
For energy measurement on system “b”, we have,
4
3
1
yprobabilit
4
1yprobabilit
2
Suppose we made an energy measurement on system “a” and obtained the result 1 . Right after this measurement the state of the combined system collapses into the state,
baee 21
If after the measurement on system “a”, we make an energy measurement on system “b”, the only possible outcome is 2 with probability one. Therefore, for entangled states measurement on one subsystem, changes the measurement results (i.e possible outcomes and the corresponding probabilities) for the other subsystem.
1.9 Density Operators for Joint Hilbert Spaces 1.9.1 Density Operators for Entangled and Unentangled States If the quantum state of a system consisting of two subsystems “a” and “b” is an unentangled state like,
bax
then the density operator for the system is,
ba
bbaa
baba
xx
xx
ˆˆˆ
ˆ
ˆ
Where, aaa ˆ and xx
bbb . Therefore, the density operator can be written as a tensor
product of the density operators of the subsystems. Another example is,
ba
bbaaeeee
ˆˆˆ
2
1
2
12121
where,
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22122111
22122111
2
1ˆ
2
1ˆ
eeeeeeee
eeeeeeee
bbbbbbbbb
aaaaaaaaa
Now consider the entangled state,
21121221
11222211
1221
2
1
ˆ
2
1
eeeeeeee
eeeeeeee
eeee
bbaabbaa
bbaabbaa
baba
The density operator for entangled states cannot be written as a tensor product, ba ˆˆ . Recall that Trace operation means trace with respect to all the states of the full Hilbert space that form a complete set. As an example, consider two different two-level systems “a” and “b”. The full Hilbert space consists of the following four states which form a complete set,
ba
ba
ba
ba
ee
ee
ee
ee
22
21
12
11
4
3
2
1
The average energy is calculated as,
kHkHk
ˆˆˆˆ4
1
Trace
Suppose, ba
ee 21 . Then,
2211ˆ eeeebbaa
and,
21
22221122
21221121
12221112
11221111
22114
1
2211
ˆˆ
ˆˆ
ˆˆ
ˆˆ
ˆˆ
ˆˆˆˆˆ
toequalanswer nonzeroagivesabovelinethirdtheonly
TraceTrace
bababbaaba
bababbaaba
bababbaaba
bababbaaba
babbaak
babbaaba
eeHHeeeeee
eeHHeeeeee
eeHHeeeeee
eeHHeeeeee
kHHeeeek
HHeeeeHH
Note that an expression of the form,
babbaaba
xeeeex 2211
equals,
bbbbaaaaeexeex 2211
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1.9.2 Partial Traces and Density Operators of Subsystems Sometimes a density operator for two (or more) systems contains too much information. The purpose of the density operator is to allow one to calculate averages. If one is interested in only system “a” but has the joint density operator for system “a” and system “b”, then one needs to “extract” a density operator
a for system “a”. This is done as follows. The density operator for system “a” is extracted from by doing a partial trace with respect to the states belonging to system “b”, i.e.,
bbbb
a
eeee 2211 ˆˆ
ˆˆ
Tracep
For unentangled states, we know that, ba ˆˆˆ Therefore,
aba
bbbbbba
bbbabbba
bbabbbab
eeee
eeee
eeee
ˆˆˆ
ˆˆˆ
ˆˆˆˆ
ˆˆˆˆˆ
2211
2211
2211
Tracep
Tracep
Now consider the entangled state,
baba
eeee 1221 2
1
2
3
11222112
12212211
3
334
1ˆ
eeeeeeee
eeeeeeee
bbaabbaa
bbaabbaa
4
10
04
3
ˆ
4
1
4
3
ˆˆ
ˆˆ
2211
2211
a
aaaa
bbbb
a
eeee
eeee
Tracep
Therefore, a is a statistical mixture of states a
e1 and a
e2 with probabilities 4
3 and
4
1,
respectively. But note that just by looking at the full state,
baba
eeee 1221 2
1
2
3
one can tell that a measurement of the energy of system “a” will yield outcomes 1 and 2 with
probabilities 4
3 and
4
1, respectively. The extracted density operator a tells exactly this but in a formal
way. Usually, entangled states of two systems yield statistical mixture like density operators for any subsystem after the partial trace operation.