Data for the publication "Structure of Cu, Ni, and CuNi Bimetallic Small Clusters Incorporated in g-C3N4: A DFT Study"
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Data for publication entitled "Structure of Cu, Ni, and CuNi Bimetallic Small Clusters Incorporated in g-C3N4: A DFT Study" by Agnieszka Drzewiecka-Matuszek, Priti Sharma, Dorota Rutkowska-Zbik obtained within the National Science Centre (Poland), POLONEZ BIS 3 project reg. no. 2022/47/P/ST4/03412, and the European Union’s Horizon 2020 research and innovation programme and Marie Skłodowska-Curie Actions grant agreement no. 945339.The repository contains DFT: PBE+D3/def2-TZVP cemeteries of the s=investigated structures.
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RepOD
创建时间:
2025-09-02



