Table of (C60)nK+ clusters

The energies and point groups (PG) of the lowest energy minima of (C60)n K+  found for n≤13.

The unit of energy is in eV and the unit of distance is the effective radius Rf (Rf=4.75 Angstrom).

Click here for the global minima in xyz format.

n
PG
Energy
1
Cinftyv
-0.716193
2
C2v -1.456328
3
C3v -2.333590
4
Td -3.362940
5
C3v -4.230639
6
C2v -5.101973
7
C2v -6.223458
8
Cs -7.098449
9
Cs -8.191296
10
C3v -9.203263
11
Cs -10.259355
12
Cs -11.345646
13
C3v -12.493364


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J. Doye © 1997