C3v対称性に属する分子


座標

molecule = {
{H, 0.000000000 , 0.000000000, 0.008000016},
{N, 0.000000000, 0.000000000 , 1.019999981},
{H, -0.954122663, 0.000000000 , 1.357333422},
{H, 0.477061838, -0.826294184 , 1.357333422}
};


指標表

C3v

E

2C3

3sv

A1

1

1

1

z

x2+y2,z2

A2

1

1

-1

Rz

E

2

-1

0

(x,y) (Rx,Ry)

(x2-y2,xy) (xz,yz)





直積表

C3v

A1

A2

E

A1

A1

A2

A2

A1

E

E

E

(A1+A2+E)