The threshold displacement energy of buckminsterfullerene C$_{60}$ and formation of the endohedral defect fullerene He@C$_{59}$

TL;DR

This study measures the energy required to displace a carbon atom from C60 and reports the first observation of an endohedral He@C59- complex, combining experimental and simulation approaches.

Contribution

It provides a semi-empirical value for the threshold displacement energy of C60 and reports the novel formation of He@C59- endohedral fullerene.

Findings

Threshold displacement energy of C60 is 24.1±0.5 eV.

First observation of He@C59- endohedral fullerene.

Insights into formation and decay mechanisms of the endohedral complex.

Abstract

We have measured the threshold center-of-mass kinetic energy for knocking out a single carbon atom from C$_{60}^-$ in collisions with He. Combining this experimental result with classical molecular dynamics simulations, we determine a semi-empirical value of 24.1$\pm$0.5~eV for the threshold displacement energy, the energy needed to remove a single carbon atom from the C$_{60}$ cage. We report the first observation of an endohedral complex with an odd number of carbon atoms, He@C$_{59}^-$, and discuss its formation and decay mechanisms.