Abstract
The TiKβ5 spectra and the electronic structure of HfTi2Hx hydrides (x = 0, 0.5, 3.0, 4.0, 4.5, 5.95) are investigated. The location of hydrogen atoms in the structure of the HfTi2H x hydrides is determined, and the hydrogen occupancies of the positions e and g are calculated. The inference is made that the hydrogen atoms occupy only the e positions at a low hydrogen content up to x = 3.0 (this is confirmed by the experimental crystallographic data) and the positions e and g at a higher hydrogen content.
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Nemnonov, S.N., Cherkashenko, V.M., Kozhanov, V.N. et al. X-ray spectroscopic study of the electronic structure and location of hydrogen atoms in HfTi2H x hydrides. Phys. Solid State 48, 30–36 (2006). https://doi.org/10.1134/S1063783406010070
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DOI: https://doi.org/10.1134/S1063783406010070