A thermodynamic criterion for the choice of flux and its validity in NaBO2-fluxed beta-BaB2O4 crystal growth

doi:10.1039/d2ce00250g

	A thermodynamic criterion for the choice of flux and its validity in NaBO2-fluxed beta-BaB2O4 crystal growth
	Luo, Wen 1,2; Wan, Songming 2,3; Jiang, Shengjie 2; Li, Bin 2
刊名	CRYSTENGCOMM
	2022-04-12
卷号	24
DOI	10.1039/d2ce00250g
通讯作者	Wan, Songming(smwan@aiofm.ac.cn)
英文摘要	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.
资助项目	Open Project of Key Laboratory of Functional Crystals and Laser Technology, TIPC, Chinese Academy of Sciences[FCLT 202001] ; Open Project of State Key Laboratory of Advanced Special Steel, Shanghai University[SKLASS 2017-01]
WOS关键词	HARDNESS ; SYSTEM
WOS研究方向	Chemistry ; Crystallography
语种	英语
出版者	ROYAL SOC CHEMISTRY
WOS记录号	WOS:000774032900001
资助机构	Open Project of Key Laboratory of Functional Crystals and Laser Technology, TIPC, Chinese Academy of Sciences ; Open Project of State Key Laboratory of Advanced Special Steel, Shanghai University
内容类型	期刊论文
源URL	[http://ir.hfcas.ac.cn:8080/handle/334002/128199]
专题	中国科学院合肥物质科学研究院
通讯作者	Wan, Songming
作者单位	1.Anhui Univ, Inst Phys Sci, Hefei 230601, Peoples R China 2.Chinese Acad Sci, Anhui Inst Opt & Fine Mech, Anhui Prov Key Lab Photon Devices & Mat, HFIPS, Hefei 230031, Peoples R China 3.Adv Laser Technol Lab Anhui Prov, Hefei 230037, Peoples R China
推荐引用方式 GB/T 7714	Luo, Wen,Wan, Songming,Jiang, Shengjie,et al. A thermodynamic criterion for the choice of flux and its validity in NaBO2-fluxed beta-BaB2O4 crystal growth[J]. CRYSTENGCOMM,2022,24.
APA	Luo, Wen,Wan, Songming,Jiang, Shengjie,&Li, Bin.(2022).A thermodynamic criterion for the choice of flux and its validity in NaBO2-fluxed beta-BaB2O4 crystal growth.CRYSTENGCOMM,24.
MLA	Luo, Wen,et al."A thermodynamic criterion for the choice of flux and its validity in NaBO2-fluxed beta-BaB2O4 crystal growth".CRYSTENGCOMM 24(2022).