Metastable isomers of Krn+ clusters
Colours of atoms correspond to the
mean charges they carry:
0.0 e - 0.125 e - 0.25 e - 0.375 e - 0.5 e
Kr3+
DIM + SO
|
DIM + SO + ID-ID
|
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Structure
|
Energy
[meV] |
Structure
|
Energy
[meV] |
|||
1 |
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2
|
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+127
|
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+152
|
Kr4+
DIM + SO
|
DIM + SO + ID-ID
|
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Structure
|
Energy
[meV] |
Structure
|
Energy
[meV] |
|||
1 |
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|
|
2
|
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+20.3
|
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+3.3 |
3 | ![]() |
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+101 | ![]() |
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+138 |
Kr5+
DIM + SO
|
DIM + SO + ID-ID
|
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Structure
|
Energy
[meV] |
Structure
|
Energy
[meV] |
|||
1 |
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|
|
2
|
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+1.0
|
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+0.6 |
3 | ![]() |
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+33.6 | ![]() |
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+6.33 |
4 | ![]() |
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+45.2 | ![]() |
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+14.7 |
5 | ![]() |
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+48.7 | ![]() |
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+46.7 |
6 | ![]() |
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+93.0 | ![]() |
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+131 |
7 | ![]() |
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+99.5 | - | - | - |
Kr6+
DIM + SO
|
DIM + SO + ID-ID
|
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Structure
|
Energy
[meV] |
Structure
|
Energy
[meV] |
|||
1 |
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|
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|
2
|
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+1.7
|
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+6.3 |
3 | ![]() |
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+2.3 | ![]() |
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+7.0 |
4 | ![]() |
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+3.8 | ![]() |
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+10.3 |
5 | ![]() |
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+32.2 | ![]() |
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+17.1 |
6 | ![]() |
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+32.6 | ![]() |
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+18.6 |
7 | ![]() |
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+48.1 | ![]() |
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+24.5 |
8 | ![]() |
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+52.0 | ![]() |
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+63.9 |
9 | ![]() |
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+59.0 | ![]() |
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+133 |
10 | ![]() |
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+87.1 | - | - | - |
11 | ![]() |
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+121 | - | - | - |
Research CPG home |
last update:
28 August, 2003
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