2026-10-13T06:01:52Z https://www.scidb.cn/oai

10.57760/sciencedb.02587 2022-09-07T17:24:01Z

2022-09-07 Date for paper“A thermodynamic criterion for the choice of flux and its validity in the NaBO2-fluxed β-BaB2O4 crystal growth” doi:10.57760/sciencedb.02587 en The choice of flux is critical and also challenging to flux crystal growth. In order to address this issue, a thermodynamic criterion for the choice of flux is proposed. Density functional theory (DFT) computations were used to study the atomic chemical potentials of beta-BaB2O4 and NaBO2 in the BaB2O4-NaBO2 eutectic system. The results verify the validity of the criterion. HARDNESS; SYSTEM; CRYSTAL Luo Wen Wan Songming Jiang Shengjie Li Bin PUBLIC https://creativecommons.org/licenses/by-nc-nd/4.0/ dataset http://www.doi.org/10.1039/d2ce00250g Science Data Bank