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Royal Society of Chemistry, Physical Chemistry Chemical Physics, 46(25), p. 31874-31883, 2023

DOI: 10.1039/d3cp03263a

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Elucidation of the synergistic effects of 3d metal (M = Cu, Co, and Ni) dopants and terminations (T = –O– and –OH) of Ti<sub>3</sub>C<sub>2</sub>T<sub>x</sub> MXenes for urea adsorption ability via DFT calculations and experiments

Journal article published in 2023 by Caihong Liang, Zhihao Yen, Teddy Salim ORCID, Yeng Ming Lam ORCID
This paper was not found in any repository, but could be made available legally by the author.
This paper was not found in any repository, but could be made available legally by the author.

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Abstract

DFT and experimental studies indicate that Ti3C2O2 with Cu, Co, and Ni dopants have better urea adsorption ability compared to undoped Ti3C2O2. It is feasible to use computational approach to predict urea adsorption of similar materials.