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Figure S1,Figure S2,Figure S3

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posted on 2025-06-02, 04:06 authored by Lin Wen, Mei Wu, Yuqing Li, Peng Li, Jie Ma
The process of AIMD simulations for the PyN-DAB adsorbates with one AmO2(H2O)32+ ion. The process of AIMD simulations for the PyN-DAB adsorbates with one AmO22+ ion. The process of AIMD simulations for the PyN-DAB adsorbates with four AmO22+ ions.

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    DOI - Is supplement to Theoretical Investigation into the Interaction Mechanism of Hexavalent Americium with Covalent Organic Framework (PyN-DAB)

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