Результаты исследований: Научные публикации в периодических изданиях › статья
Ultraviolet activation of thermal decomposition of alpha-alane. / Gabis, I.E.; Voyt, A.P.; Chernov, I.A.; Kuznetsov, V.G.; Baraban, A.P.; Elets, D.I.; Dobrotvorsky, M.A.
в: International Journal of Hydrogen Energy, Том 37, № 19, 2012, стр. 14405-14412.Результаты исследований: Научные публикации в периодических изданиях › статья
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TY - JOUR
T1 - Ultraviolet activation of thermal decomposition of alpha-alane
AU - Gabis, I.E.
AU - Voyt, A.P.
AU - Chernov, I.A.
AU - Kuznetsov, V.G.
AU - Baraban, A.P.
AU - Elets, D.I.
AU - Dobrotvorsky, M.A.
PY - 2012
Y1 - 2012
N2 - We investigated activation of thermal dehydriding of a-AlH3 crystal by preliminary irradiation by ultraviolet light using thermal desorption spectroscopy, barometry, and cathode luminescence methods. It is shown that hydrogen vacancies appear due to irradiation; they serve as points where metal nuclei probably appear, so dehydriding becomes significantly faster. Possible explanation of transformation of hydrogen vacancies to metal phase nuclei is suggested: new vacancies are more likely to appear near the first one compared to remote places. Using density functional theory method we calculated the electronic structure of stoichiometric a-AlH3 and a-AlH3 with a hydrogen atom removed from a regular lattice site with a vacancy in place of it. It is suggested that an appearance of a new vacancy near the first vacancy needs less energy compared to the first one. From cathode luminescence data we see that appearance of vacancies can also be activated thermally. The model of hydrogen desorption from a-AlH3 activated
AB - We investigated activation of thermal dehydriding of a-AlH3 crystal by preliminary irradiation by ultraviolet light using thermal desorption spectroscopy, barometry, and cathode luminescence methods. It is shown that hydrogen vacancies appear due to irradiation; they serve as points where metal nuclei probably appear, so dehydriding becomes significantly faster. Possible explanation of transformation of hydrogen vacancies to metal phase nuclei is suggested: new vacancies are more likely to appear near the first one compared to remote places. Using density functional theory method we calculated the electronic structure of stoichiometric a-AlH3 and a-AlH3 with a hydrogen atom removed from a regular lattice site with a vacancy in place of it. It is suggested that an appearance of a new vacancy near the first vacancy needs less energy compared to the first one. From cathode luminescence data we see that appearance of vacancies can also be activated thermally. The model of hydrogen desorption from a-AlH3 activated
KW - Alane
KW - Decomposition kinetics
KW - UV activation
KW - Dehydriding kinetics
KW - Electronic structure
KW - Hydrogen vacancies
U2 - 10.1016/j.ijhydene.2012.07.042
DO - 10.1016/j.ijhydene.2012.07.042
M3 - Article
VL - 37
SP - 14405
EP - 14412
JO - International Journal of Hydrogen Energy
JF - International Journal of Hydrogen Energy
SN - 0360-3199
IS - 19
ER -
ID: 5359683