Yi. Prilutski et Gg. Shapovalov, EFFECT OF PRESSURE ON THE STRUCTURE AND LATTICE-DYNAMICS OF FULLERENECRYSTAL C-60, Physica status solidi. b, Basic research, 201(2), 1997, pp. 361-370
The low-temperature orientationally ordered crystalline phase of fulle
rene C-60 was investigated in dependence on the external pressure. An
assumption was made that the energy of the lattice includes two contri
butions: a Lennard-Jones (12-6) potential and electrostatic interactio
n. The vibrational spectrum of C-60 crystal was calculated using the a
tom-atom potential method. The frequencies of intermolecular modes as
functions of external pressure were studied. The sound velocities, ela
stic constants and bulk modulus are calculated. The dependence of soun
d velocities in fullerene crystal C-60 on the external pressure is inv
estigated. The results obtained are in good agreement with the availab
le experimental data.