D3h対称性に属する分子


座標

molecule = {
{C, 0.000000000, 0.000000000, -0.774227289},
{C, 0.000000000, 0.000000000, 0.774227289},
{H, 0.895300484, -0.516901977 , 1.154368669},
{H, -0.895300486, -0.516901975 , 1.154368669},
{H, 0.000000001, 1.033803952 , 1.154368669},
{H, -0.895300486, -0.516901975, -1.154368669},
{H, 0.895300484, -0.516901977, -1.154368669},
{H, 0.000000001 , 1.033803952, -1.154368669}
};


指標表

D3h

E

2C3

3C2

sh

2S3

3sv

A1'

1

1

1

1

1

1

x2+y2,z2

A1"

1

1

1

-1

-1

-1

A2'

1

1

-1

1

1

-1

Rz

A2"

1

1

-1

-1

-1

1

z

E'

2

-1

0

2

-1

0

(x,y)

(x2-y2,xy)

E"

2

-1

0

-2

1

0

(Rx,Ry)

(xz,yz)




直積表

D3h

A1'

A1"

A2'

A2"

E'

E"

A1'

A1'

A1"

A1"

A1'

A2'

A2'

A2"

A1'

A2"

A2"

A2'

A1"

A1'

E'

E'

E"

E'

E"

(A1'+A2'+E')

E"

E"

E'

E"

E'

(A1"+A2"+E")

(A1'+A2'+E')