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Vibrational spectroscopy of hydroxylated alpha-Al2O3(0001) surfaces with and without water: An ab initio molecular dynamics study

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Nagata,  Yuki
Dept. Bonn: Molecular Spectroscopy, MPI for Polymer Research, Max Planck Society;

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Melani, G., Nagata, Y., Wirth, J., & Saalfrank, P. (2018). Vibrational spectroscopy of hydroxylated alpha-Al2O3(0001) surfaces with and without water: An ab initio molecular dynamics study. The Journal of Chemical Physics, 149(1): 014707. doi:10.1063/1.5023347.


Cite as: http://hdl.handle.net/21.11116/0000-0001-DBC2-D
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