Revealing the immobilization mechanism of Nd(III) through in‐situ C–S–H formation: Status and coordination of Nd

This study aims to reveal the immobilization mechanism of Nd(III) during the in situ formation of C–S–H. The experimental results indicate that during the formation of C–S–H, Nd was incorporated into its dreierketten silicate chain as Nd tetrahedra via substituting Si tetrahedra at the Q2b site, whi...

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Bibliographic Details
Published in:Journal of the American Ceramic Society 2026-01, Vol.109 (1), p.n/a
Main Authors: Ma, Haosen, Tang, Yanjie, Lu, Heyu, Chen, Wei, Li, Neng, Li, Qiu
Format: Article
Language:English
Subjects:
Calcium silicate hydrate
C–S–H
Density functional theory
DFT
Free energy
Heat of formation
Immobilization
immobilization mechanism
Nd coordination
Silicon
Tetrahedra
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