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Álvarez-Barcia, S., Flores, J. R. (2009) The interaction of Al atoms with water molecules: A theoretical study. The Journal of Chemical Physics, 131 (17). 174307pp. doi:10.1063/1.3253049

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Reference TypeJournal (article/letter/editorial)
TitleThe interaction of Al atoms with water molecules: A theoretical study
JournalThe Journal of Chemical Physics
AuthorsÁlvarez-Barcia, S.Author
Flores, J. R.Author
Year2009 (November 7)Volume131
Issue17
PublisherAIP Publishing
DOIdoi:10.1063/1.3253049Search in ResearchGate
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Mindat Ref. ID2331966Long-form Identifiermindat:1:5:2331966:4
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Full ReferenceÁlvarez-Barcia, S., Flores, J. R. (2009) The interaction of Al atoms with water molecules: A theoretical study. The Journal of Chemical Physics, 131 (17). 174307pp. doi:10.1063/1.3253049
Plain TextÁlvarez-Barcia, S., Flores, J. R. (2009) The interaction of Al atoms with water molecules: A theoretical study. The Journal of Chemical Physics, 131 (17). 174307pp. doi:10.1063/1.3253049
In(2009, November) The Journal of Chemical Physics Vol. 131 (17) AIP Publishing

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Álvarez-Barcia, Sonia, Flores, Jesús R. (2010) How H2 can be formed by the interaction of Al atoms with a few water molecules: A theoretical study. Chemical Physics, 374. 131-137 doi:10.1016/j.chemphys.2010.07.013
Álvarez-Barcia, S., Flores, J. R. (2011) The oxidation of Al atoms embedded in water clusters: A dynamical study of the relay (Grotthuss-like) mechanism. The Journal of Chemical Physics, 134 (24). 244305pp. doi:10.1063/1.3602222
Rey-Villaverde, R., Álvarez-Barcia, S., Flores, J. R. (2012) The dynamics of the C + PH3 reaction: A theoretical study. The Journal of Chemical Physics, 137 (1). 14316pp. doi:10.1063/1.4730914
Álvarez-Barcia, Sonia, Flores, Jesús R. (2009) A high-accuracy theoretical study of the AlOH2 system. Chemical Physics Letters, 470. 196-202 doi:10.1016/j.cplett.2009.01.069
Álvarez-Barcia, Sonia, Flores, Jesús R. (2011) A theoretical study of the dynamics of the Al+H2O reaction in the gas-phase. Chemical Physics, 382. 92-97 doi:10.1016/j.chemphys.2011.03.004
Álvarez-Barcia, S., Flores, J. R. (2014) Hydrogen migration dynamics in hydrated Al clusters: The Al17(−)·H2O system as an example. The Journal of Chemical Physics, 140 (8). 84313pp. doi:10.1063/1.4866583
Álvarez-Barcia, Sonia, Flores, Jesús R. (2012) Size, Adsorption Site, and Spin Effects in the Reaction of Al Clusters with Water Molecules: Al17and Al28as Examples. The Journal of Physical Chemistry A, 116 (30). 8040-8050 doi:10.1021/jp303911s
Álvarez-Barcia, Sonia, Flores, Jesús R. (2011) How Fast Do Microhydrated Al Clusters React: A Theoretical Study. The Journal of Physical Chemistry C, 115 (50). 24849-24857 doi:10.1021/jp208258j
Álvarez-Barcia, Sonia, Flores, Jesús R., Granucci, Giovanni, Persico, Maurizio (2013) Theoretical Study of the Chemiluminescence of the Al + H2O Reaction. The Journal of Physical Chemistry A, 117 (1). 67-74 doi:10.1021/jp310034c
Álvarez-Barcia, Sonia, Flores, Jesús R. (2016) Can alumina particles be formed from Al hydroxide in the circumstellar media? A first-principles chemical study. Physical Chemistry Chemical Physics, 18 (8). 6103-6112 doi:10.1039/c5cp06676j
Pacheco-Blas, M. A., Novaro, O. A., Pacheco-Sánchez, J. H. (2010) A theoretical approach to the photochemical activation of matrix isolated aluminum atoms and their reaction with methane. The Journal of Chemical Physics, 133 (17). 174307pp. doi:10.1063/1.3499813
 
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