Chemistry Reference
In-Depth Information
Care must be taken in noting that the same operation R may have a
different effect when acting on a different basis. The transformation under
C
a
of the d-functions in the xy-plane:
d
x
2
--
y
2
/
sin
2
d
xy
/
sin
2
u
cos 2
w;
u
sin 2
w
ð
12
:
22
Þ
gives in fact
cos 2
a
sin2
a
C
a
ð
d
x
2
--
y
2
d
xy
Þ¼ð
C
a
d
x
2
y
2
C
a
d
xy
Þ¼ð
d
x
2
y
2
d
xy
Þ
sin2
a
cos 2
a
¼ð
d
x
2
--
y
2
d
xy
Þ
D
d
ð
C
a
Þ
ð
12
:
23
Þ
Therefore, it is always necessary to specify the basis which the matrix
representative refers to. These and other matrix representatives of
different symmetry operations may be found elsewhere (Magnasco,
2007).
As a last point on symmetry, it must be recalled that
then RS
¼
T in function space
and
Dð
R
ÞDð
S
Þ¼Dð
T
Þ
in matrix space
If RS
¼
T in coordinate space
;
ð
12
:
24
Þ
12.2 GROUP THEORETICAL METHODS
Let us now briefly introduce the axioms defining the concept of a
group.
An abstract group G
f
G
1
; ...;
G
h
g
of order h is given by a closed set
of h elements satisfying the following properties:
;
G
2
(i) There is a composition law (usually, but not necessarily, the
multiplication law) such that, for G
r
and G
s
belonging to G,
G
r
G
s
¼
G
t
still belongs to G (we then say that a group is a set
closed with respect to symbolic multiplication).
(ii) The composition law is associative:
ð
G
r
G
s
Þ
G
t
¼
G
r
ð
G
s
G
t
Þ
.
(iii) There is an identity (or neutral) element G
m
, such that G
r
G
m
¼
G
m
G
r
¼
G
r
.
(iv) Each element has an inverse G
1
, such that G
r
G
1
¼
G
r
G
r
¼
r
r
G
m
.