scholarly journals Local Structure of V Dopants in TiO2 Nanoparticles: X-ray Absorption Spectroscopy, Including Ab-Initio and Full Potential Simulations

2016 ◽  
Vol 120 (14) ◽  
pp. 7457-7466 ◽  
Author(s):  
Giacomo Rossi ◽  
Marco Calizzi ◽  
Valeria Di Cintio ◽  
Sotirios Magkos ◽  
Lucia Amidani ◽  
...  
2020 ◽  
Vol 22 (42) ◽  
pp. 24299-24309
Author(s):  
Vera Cuartero ◽  
Virginia Monteseguro ◽  
Alberto Otero-de-la-Roza ◽  
Mourad El Idrissi ◽  
Olivier Mathon ◽  
...  

X-ray absorption spectroscopy and ab initio calculations unveil the correlation between local, vibrational and electronic structure of CuO under high pressure.


2018 ◽  
Vol 20 (1) ◽  
pp. 221-231 ◽  
Author(s):  
Zakaria El Koura ◽  
Giacomo Rossi ◽  
Marco Calizzi ◽  
Lucia Amidani ◽  
Luca Pasquini ◽  
...  

X-ray absorption spectroscopy and ab initio simulations unravel the local structure of vanadium and nitrogen dopants in anatase thin films.


2019 ◽  
Author(s):  
Jisue Moon ◽  
Carter Abney ◽  
Dmitriy Dolzhnikov ◽  
James M. Kurley ◽  
Kevin A. Beyer ◽  
...  

The local structure of dilute CrCl<sub>3</sub> in a molten MgCl<sub>2</sub>:KCl salt was investigated by <i>in situ</i> x-ray absorption spectroscopy (XAS) at temperatures from room temperature to 800<sup>o</sup>C. This constitutes the first experiment where dilute Cr speciation is explored in a molten chloride salt, ostensibly due to the compounding challenges arising from a low Cr concentration in a matrix of heavy absorbers at extreme temperatures. CrCl<sub>3</sub> was confirmed to be the stable species between 200 and 500<sup>o</sup>C, while mobility of metal ions at higher temperature (>700<sup>o</sup>C) prevented confirmation of the local structure.


2004 ◽  
Vol 108 (42) ◽  
pp. 16372-16376 ◽  
Author(s):  
Aline Léon ◽  
Oliver Kircher ◽  
Jörg Rothe ◽  
Maximilian Fichtner

2013 ◽  
Vol 204 ◽  
pp. 257-265 ◽  
Author(s):  
Natkrita Prasoetsopha ◽  
Supree Pinitsoontorn ◽  
Atipong Bootchanont ◽  
Pinit Kidkhunthod ◽  
Pornjuk Srepusharawoot ◽  
...  

1991 ◽  
Vol 44 (13) ◽  
pp. 6961-6972 ◽  
Author(s):  
J. B. Boyce ◽  
F. G. Bridges ◽  
T. Claeson ◽  
T. H. Geballe ◽  
G. G. Li ◽  
...  

2017 ◽  
Vol 4 (23) ◽  
pp. 1700755 ◽  
Author(s):  
Tristan Petit ◽  
Jian Ren ◽  
Sneha Choudhury ◽  
Ronny Golnak ◽  
Sreeju S. N. Lalithambika ◽  
...  

2021 ◽  
pp. 126223
Author(s):  
H. Arima-Osonoi ◽  
K. Yamazaki ◽  
R. Simura ◽  
T. Sugawara ◽  
K. Yubuta ◽  
...  

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