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of Quantum Theory and the physical phenomena that take place in systems
where Quantum Mechanics applies, are very dierent from those of classical
mechanics.
the momenta, the kinetic or the potential energy of the particles) are num-
you learn what an operator is and which operators represent the dynamical
shorthand for the following rules: take the argument x of f(x) and calculate
This concept can be generalized to dene rules that use as input a function
function is to numbers.
^
(x) = O(x) (2.1)
the kinds of operators that you will encounter in your study of Quantum
^ x dened by
Mechanics. The operator O
^ x f (x; y; z) = xf (x; y; z)
O (2.2)
acts on a function f (x; y; z) to produce the function xf(x; y; z). This rule is
^ x sin(x2 ) = x sin(x2 )
O
^ x [xy ln x] = x2 y ln x
O
QM 2. Dynamical variables and operators, May 30, 2005 3
tion multiplied by x.
Another example is
a function f (x; y; z) into the function V (x; y; z) f(x; y; z). If V (x) = kx2 =2
then
^ kx2
V f(x; y; z) = f (x; y; z)
2
h
@
p^x (x; y; z) = (x; y; z) (2.4)
i @x
p
h
is Planck's constant and i = 1. The previous operators involved multi-
then
p^x (x; y; z) = h
kx exp[ikx x + iky y + ikz z]
@
h
p^y (x; y; z) = (x; y; z) (2.5)
i @y
I do next.
C^ A^ + B
^
^ = A
C ^ + B
^
^ A^
D
QM 2. Dynamical variables and operators, May 30, 2005 5
is dened by
^ = (A)
D ^
We can combine these rules to create new operators. For example, the
operator C^ dened by
C^ = p^x + 2O
^x
shown below:
^ =h
C
@
+ 2x
i @x
A^B
^ = A(
^ B)
^ = A
^ where = B
^ (2.6)
^ has
This means: take the function and calculate the eect the operator B
on it. Call the function obtained in this way . Apply the operator A^ to .
^ x , where O
p^x O ^ x is dened by Eq. 2.2 and p^x is dened by Eq. 2.4:
^ x (x; y; z) = p^x (O
p^x O ^ x (x; y; z)) = p^x (x(x; y; z))
h
@
= (x(x; y; z))
i @x
h
h
@(x; y; z)
= (x; y; z) + x (2.7)
i i @x
@
Note that in the calculation performed above, @x
acts on x(x; y; z).
(x; y; z):
no matter what (x; y; z) is. When this happens, we say that the operators
^ x p^y = p^y O
O ^x
^ 3 (x; y; z) = O
O ^ 2 (O
^ x (x; y; z)) = O
^ 2 (x) = O
^ x (x2 ) = x3 (x; y; z)
x x x
for every function . The calculations performed in Eqs. 2.7{2.10 show that
^ B]
[A; ^ A^B
^B
^ A^ (2.11)
^ B]
The commutator [A; ^ is an operator.
^ is said to be equal to 0 if O
An operator O ^ is identically 0 for every
is equal to 0:
^ B]
[A; ^ = (A^B
^ B
^ A)
^ = A^B
^ B
^ A
^ =0
The commutator [^ ^ x ] can be easily calculated from Eqs. 2.7 and 2.8:
px ; O
^ x ] = p^xO
px ; O
[^ ^ x p^x = h
^x O
(2.12)
i
Because this equality is valid for any function , we can write that
[^ ^x] = h
px ; O
(2.13)
i
Exercise 2.1 In parts (c) and (d), V (x) is a function of x and V^ = V (x).
(a) Calculate [^ ^ x2 ].
px ; O
^ x ].
px; O
(b) Calculate [^
px ; V^ ].
(c) Calculate [^
py ; V^ ].
(d) Calculate [^
(e) Calculate [^
px ; p^y ].
p6x ; p^x ].
(f ) Calculate [^
^ dened by
(a) Is K
Z +1
^
K(x) (x y)(y)dy
1
an operator?
(b) Calculate [^ ^
px; K].
^
(c) Take (z) = exp[(z=)2 ] in part (a) and calculate K(x) for (x) = x
^
A(a ^ + bA
+ b) = aA ^ (2.14)
Here a and b are complex numbers and and are arbitrary functions. An
^ 2.
(check that this is true). An example of a nonlinear operator is S
^
S(a + b) = (a + b)2 = a2 2 + b2 2 + 2ab
^
S(a ^ + bS
+ b) = aS ^ = a 2 + b2
QM 2. Dynamical variables and operators, May 30, 2005 10
^ d2 d
B(x) a 2 (x) + b (x)
dx dx
^
C(x) sin((x))
are: the position vector r = fx; y; zg (in Cartesian coordinates) and the
dx
px = m
dt
dy
py = m
dt
and
dz
pz = m
dt
QM 2. Dynamical variables and operators, May 30, 2005 11
The derivatives with respect to time t are the components of the velocity
kinetic energy
pp p2 + p2y + p2z
= x
2m 2m
the positions of all particles and the momenta of all particles. The interaction
K is the sum of the kinetic energies of each particle. The total energy is
If you know how the positions and the momenta of a classical system
change in time, you know all there is to know about the mechanics of that
system.
QM 2. Dynamical variables and operators, May 30, 2005 12
^x, O
O ^ y and O
^ z dened earlier.
The position operator can be easily dened for a system with many par-
ticles. For example, if a system has three particles with classical position
vectors r(1), r(2), and r(3), the position operator for particle 1, with coor-
^r(1)(r(1); r(2); r(3)) = ix(1)(r(1); r(2); r(3)) + jy(1)(r(1); r(2); r(3)) + kz(1)(r(1); r(2); r(3
Here (r(1); r(2); r(3)) (x(1); y(1); z(1); x(2); y(2); z(2); x(3); y(3); z(3))
is an arbitrary function. The operators ^r(2) and ^r(3) that represent the
Exercise 2.4 Show that in a system with two particles, the operators ^r(1)
the coordinates of all the particles. If, for a one-particle system, the classical
potential energy is V (r) = V (x; y; z), then the operator V^ representing this
We can generalize this to any quantity that depends only on coordinates. The
^ corresponding to
of coordinates (but not of momenta), then the operator O
it is
^
O(r(1); r(2); : : : ; r(N )) = O(r(1); r(2); : : : ; r(N))(r(1); r(2); : : : ; r(N))
(2.19)
the particle and vx , vy , and vz are the components of the velocity vector:
h
@
p^x (x; y; z) = (x; y; z) (2.20)
i @x
h
@
p^y (x; y; z) = (x; y; z) (2.21)
i @y
h
@
p^z (x; y; z) = (x; y; z) (2.22)
i @z
p
Here h
is Planck's constant, whose value is given in Appendix 1, and i = 1
with components fpx (`); py (`); pz (`)g and a position r(`) with components
fx(`); y(`); z(`)g. For example, the operator corresponding to the y-component
h
@
p^y (3)(r(1); : : : ; r(N )) = (r(1); : : : ; r(N))
i @y(3)
system is
pp p2x + p2y + p2z
K= = (2.23)
2m 2m
^ p
^ =p ^ p^2 + p^2y + p^2z
K = x (2.24)
2m 2m
To see what this operator does when applied to a function (r) = (x; y; z),
p^2x 1
= p^x (^
px)
2m 2m
The rule says: act rst with p^x and then act with p^x on the result. Using
Similarly
!2
p^2y 1 h
@ 2 (x; y; z)
= (2.26)
2m 2m i @y 2
and
!2
p^2z 1 h
@ 2 (x; y; z)
= (2.27)
2m 2m i @z 2
QM 2. Dynamical variables and operators, May 30, 2005 16
The negative sign comes from the relation i2 = 1. I can also use the
denition
@2 @2 @2
+ + (2.29)
@x2 @y 2 @z 2
with the understanding that such equations are meaningful only when both
How about systems having many particles? The classical kinetic energy
is obtained by using Eq. 2.30 for the kinetic energy of each particle:
N
X
^ = ^ (`) p
p ^ (`)
K
`=1 2m(`)
x 14. The total energy (the Hamiltonian). In classical mechanics, the total
H =K +V
is the sum of the kinetic energy K and the potential energy V . The operator
^ is
H
^ =K
H ^ + V^ (2.32)
^
H(r(1); ^
: : : ; r(N )) = K(r(1); : : : ; r(N )) + V^ (r(1); : : : ; r(N))
!
N
X 2
h @ 2 @2 @ 2
= + +
`=1 2m(`) @x(`)2 @y(`)2 @z(`)2
+ V (r(1); : : : ; r(N))(r(1); : : : ; r(N)) (2.33)
x 15. Angular momentum. I come now to the last operator that I consider
L=rp
I remind you of the rules for calculating the cross product, which can be
QM 2. Dynamical variables and operators, May 30, 2005 18
written as a determinant:
i j k
L=rp= x y z (2.34)
px py pz
gives
y z x z x y
L = i
j
+ k
py pz
px pz
px py
and
There are all kinds of rules for remembering these equations. I give you
Metiu's rule: remember a book where the equations are written down and
and
!
^z = h
L
@
x y
@
(2.41)
i @y @x
^2 = L
L ^ 2x + L
^ 2y + L
^ 2z (2.43)
p 2
Exercise 2.7 For r = x + y 2 + z 2 and a a real number, show that (see
WorkBookQM.2.2)
^ z ear = 0
L
^ 2 ear = 0
L
^ z ear z
L = 0
^ 2 ear z
L = 2h2 ear z
z(x + iy)
(x; y; z) =
x2 + y 2 + z 2
then
^z = h
L
and
^ 2 = 6h2
L
The momentum operator of particle ` with Cartesian coordinates x(`); y(`); z(`)
h
@
p^x(`) = (2.44)
i @x(`)
QM 2. Dynamical variables and operators, May 30, 2005 21
@
h
p^y (`) = (2.45)
i @y(`)
@
h
p^z (`) = (2.46)
i @z(`)
In a system for which V (r(1); : : : ; r(N)) is the classical potential energy, the
The rule is: multiply by the classical formula V (r(1); : : : ; r(N)) for the
potential energy.
components
!
^ x (`) = h
L
y(`)
@
z(`)
@
(2.49)
i @z(`) @y(`)
!
^ y (`) = h
@ @
L z(`) x(`) (2.50)
i @x(`) @z(`)
!
^ h
@ @
Lz (`) = x(`) y(`) (2.51)
i @y(`) @x(`)
^2 = L
L ^2 + L
^2 + L
^2 (2.52)
x y z
QM 2. Dynamical variables and operators, May 30, 2005 22
In later chapters, I will explain how these operators are connected to mea-
z = a + ib(1) (2.53)
where a and b are two real numbers called the real and imaginary parts of z,
respectively, and
p
i= 1 (2.54)
The notations Re(z) and Im(z) are used for the real and imaginary parts of
i2 = 1 (2.55)
Here are the operations you can perform with two complex numbers z1 =
z1 a1 + ib1 a1 a2 + b1 b2 b1 a2 a1 b2
= = 2 2
+i 2 (2.59)
z2 a2 + ib2 a2 + b2 a2 + b22
z a ib (2.60)
r
b
q
a
the form
z = exp[i] (2.61)
a = cos
b = sin
QM 2. Dynamical variables and operators, May 30, 2005 25
p
= + a2 + b2 (2.63)
!
b
= arctan with 0 < 2 (2.64)
a
p
jzj = z z (2.65)
q q
jzj = ( exp[i])( exp[i]) = 2 = jj (2.66)
where jj is the absolute value of the real number . If we use the form
z = a + ib, then
q p p
jzj = (a ib)(a + ib) = a2 + iab iab + b2 = a2 + b2 (2.67)
y = 3(1:7 2:1i)
2 + 1:3i
m =
3 + 1:1i
ei + ei
cos =
2
and
i h i i
sin = e ei
2
x 18. Complex functions of real variables. Now that we know how to per-
can dene functions whose argument is a real number and whose value is a
z = () = exp[i]
with a real number. Since the values of () are complex numbers, you can
handle it according to the rules in x17. For example, the complex conjugate