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- First Observation of the FCC to Trigonal/Rhombohedral Transition of Pure Dimerized C60 Under High Pressure hal link

Auteur(s): Papoular R. J., Le Parc R., Dmitriev V., Davydov V. A., Rakhmanina A. V., Agafonov V.

(Article) Publié: Fullerenes Nanotubes And Carbon Nanostructures, vol. 18 p.386 – 391 (2010)


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Résumé:

Similarly to preformed polymeric phases such as 1D-Pmnn [O] or 2D-Immm [T], and in contrast to monomeric FCC C60, dimeric C60 [D or R'] is expected to yield new polymerized phases of higher dimensions when subjected to high pressure. We have carried out an in-situ high-pressure powder diffraction experiment in a diamond anvil cell using MoKagr laboratory X-rays, on a pure dimeric sample previously carefully characterized at ambient pressure using synchrotron X-ray HR XRPD and Raman spectroscopy. A transition is indeed observed from 1.2 to 8.6 GPa. A robust analysis shows that the volume per C60 unit decreases from 689 Aring3 (0 GPa) to 550 Aring3 (8.6 GPa), resulting in a 20% effect. The new phase can no longer be described by a cubic (FCC) unit cell, whereas it can now be indexed and LeBail-refined using a trigonal/rhombohedral unit cell predicted by Dzyabchenko et al. in 1999.