Geodesic
Simulation of hydrogen molecules adsorption on alone fullerenes
Izvestiya Instituta Matematiki i Informatiki Udmurtskogo Gosudarstvennogo Universiteta, no. 2 (2006), pp. 121-124 
A. A. Vakhrushev; A. V. Vakhrushev; A. M. Lipanov; M. V. Suetin. Simulation of hydrogen molecules adsorption on alone fullerenes. Izvestiya Instituta Matematiki i Informatiki Udmurtskogo Gosudarstvennogo Universiteta, no. 2 (2006), pp. 121-124. http://geodesic.mathdoc.fr/item/IIMI_2006_2_a28/
@article{IIMI_2006_2_a28,
     author = {A. A. Vakhrushev and A. V. Vakhrushev and A. M. Lipanov and M. V. Suetin},
     title = {Simulation of hydrogen molecules adsorption on alone fullerenes},
     journal = {Izvestiya Instituta Matematiki i Informatiki Udmurtskogo Gosudarstvennogo Universiteta},
     pages = {121--124},
     year = {2006},
     number = {2},
     language = {ru},
     url = {http://geodesic.mathdoc.fr/item/IIMI_2006_2_a28/}
}
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Voir la notice de l'article provenant de la source Math-Net.Ru

Simulation of adsorption of hydrogen molecules on alone fullerenes under different thermodynamic conditions is done by method of molecular dynamics. Adsorption isotherms are calculated. Thermodynamic conditions essential for hydrogen accumulation by fullerenes are established. Kinetics of adsorption and desorption processes are investigated and maximum value of adsorbed hydrogen molecules are defined.

[1] Hirscher M., Becher M., Haluska M., Quintel A., Skakalova V., Choi Y.-M., Dettlaff-Weglikowska U., Roth S., Stepanek I., Bernier P., Leonhardt A., Fink J., “Hydrogen storage in carbon nanostructures”, Journal of Alloys and Compounds, 330–332 (2002), 654–658 | DOI

[2] Kheerman D. V., Metody kompyuternogo eksperimenta v statisticheskoi fizike, Nauka, M., 1990, 176 pp.