Molecular dynamics computer simulation and experimental data for diffusion of cyclohexane and toluene solutions of C-60 inside porous sol-gel glass are reported. The average pore diameter of the glass used in the experiment was 2.8 nm, similar to that used in computer simulations, 2.5 nm. Translational motion of C-60 in solutions in the pores is about 10 times slower than the diffusion in the carrier. It is shown that thermally stable sol-gel glass samples can be uniformly impregnated with C-60 by diffusing C-60 toluene solutions into the pores. Optical spectra of wet and dry impregnated samples are similar.
机构:
Southern Fed Univ, Int Res Ctr Smart Mat, Rostov Na Donu 344090, Russia
Univ Turin, Dept Chem, I-10125 Turin, ItalySouthern Fed Univ, Int Res Ctr Smart Mat, Rostov Na Donu 344090, Russia
Budnyk, Andriy P.
Cherkasova, Svetlana O.
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Southern Fed Univ, Int Res Ctr Smart Mat, Rostov Na Donu 344090, RussiaSouthern Fed Univ, Int Res Ctr Smart Mat, Rostov Na Donu 344090, Russia