Clusters

E_e

E_ZPE

E_H

E_G

v_O-O

S² before

S² after

${\text{AuSiO}}_3^{–}{\text{-O}}_2$

S₁

1.86

1.77

1.82

1.24

920.0

0

0

S₃

1.57

1.51

1.53

1.07

1111.8

2.0081

2

${\text{AuSi}}_2{\text{O}}_5^{–}{\text{-O}}_2$

S₁

1.62

1.54

1.57

1.05

929.6

0

0

S₃

1.38

1.32

1.34

0.92

1130.3

2.0083

2

${\text{AuSi}}_3{\text{O}}_7^{–}{\text{-O}}_2$

S₁

0.68

0.61

0.64

0.11

967.2

0

0

S₃

1.13

1.10

1.10

0.72

1198.2

2.0075

2

${\text{AgSiO}}_3^{–}{\text{-O}}_2$

S₁

1.27

1.20

1.23

0.73

976.5

0

0

S₃

1.20

1.17

1.17

0.81

1137.0

2.0075

2

${\text{AgSi}}_{\text{2}}{\text{O}}_5^{–}{\text{-O}}_2$

S₁

0.97

0.90

0.93

0.43

998.4

0

0

S₃

0.97

0.94

0.94

0.58

1156.1

2.0075

2

${\text{AgSi}}_3{\text{O}}_7^{–}{\text{-O}}_2$

S₁

0.16

0.11

0.13

-0.38

1138.0

0

0

S₃

0.61

0.59

0.59

0.25

1240.2

2.0076

2

${\text{CuSiO}}_3^{–}{\text{-O}}_2$

S₁

2.19

2.11

2.14

1.64

965.12

0

0

S₃

2.00

1.96

1.97

1.55

1088.4

2.0071

2

${\text{CuSi}}_{\text{2}}{\text{O}}_5^{–}{\text{-O}}_2$

S₁

1.94

1.85

1.89

1.37

986.1

0

0

S₃

1.85

1.80

1.81

1.40

1100.2

2.007

2

${\text{CuSi}}_3{\text{O}}_7^{–}{\text{-O}}_2$

S₁

1.18

1.11

1.13

0.63

1018.9

0

0

S₃

1.38

1.34

1.35

0.92

1138.0

2.0069

2