AutoCN

Calculation results on an adjacent matrix of the Cl2 crystal structure

1: Cl2/T=90K

The radii system of Slater is used

Cl1

Atoms

Dist.

SA

rs-rs

rs-Rsd

Rsd-rs

Rsd-Rsd

Ovr.

vCl1

1.992

26.16

0.000

1.383

1.383

7.949

3

sCl1

3.283

12.76

No

No

No

0.686

1

sCl1

3.283

12.76

No

No

No

0.686

1

sCl1

3.702

5.40

No

No

No

0.016

1

sCl1

3.702

5.40

No

No

No

0.016

1

wCl1

3.748

7.81

No

No

No

0.002

0

wCl1

3.816

4.86

No

No

No

No

0

wCl1

3.816

4.86

No

No

No

No

0

wCl1

3.816

4.86

No

No

No

No

0

wCl1

3.816

4.86

No

No

No

No

0

wCl1

3.935

4.99

No

No

No

No

0

wCl1

3.935

4.99

No

No

No

No

0

*Cl1

4.243

0.16

No

No

No

No

0

*Cl1

4.243

0.16

No

No

No

No

0

Coordination numbers for Cl2/T=90K

Atom

CN

Composition

Overlapping type

0

1

2

3

4

Cl1

1

Cl1

9

4

0

1

0

 

Symbols 'v', 's', 'w' and '*' denominate valent, non-valent specific, van der Waals and 'indirect' interatomic contacts.

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