PMID- 35815496
OWN - NLM
STAT- PubMed-not-MEDLINE
LR  - 20220725
IS  - 1520-510X (Electronic)
IS  - 0020-1669 (Linking)
VI  - 61
IP  - 29
DP  - 2022 Jul 25
TI  - Crystallization of A(3)Ln(BO(3))(2) (A = Na, K; Ln = Lanthanide) from a Boric 
      Acid Containing Hydroxide Melt: Synthesis and Investigation of Lanthanide Borates 
      as Potential Nuclear Waste Forms.
PG  - 11232-11242
LID - 10.1021/acs.inorgchem.2c01301 [doi]
AB  - A series of alkali metal rare-earth borates were prepared via high-temperature 
      flux crystal growth, and their structures were characterized by single crystal 
      X-ray diffraction (SXRD). Na(3)Ln(BO(3))(2) (Ln = La-Lu) crystallize in the 
      monoclinic space group P2(1)/n, the potassium series K(3)Ln(BO(3))(2) (Ln = 
      La-Tb) crystallize in the orthorhombic space group Pnma, while the Ln = Dy, Ho, 
      Tm, Yb analogues crystallize in the orthorhombic space group Pnnm. To demonstrate 
      the generality of this synthetic technique, high-entropy oxide (HEO) compositions 
      K(3)Nd(0.15(1))Eu(0.20(1))Gd(0.20(1))Dy(0.22(1))Ho(0.23(1))(BO(3))(2) and 
      K(3)Nd(0.26(1))Eu(0.29(1))Ho(0.22(1))Tm(0.14(1))Yb(0.10(1))(BO(3))(2) were 
      obtained in single crystal form. Radiation damage investigations determined that 
      these borates have a high radiation damage tolerance. To assess whether trivalent 
      actinide analogues of Na(3)Ln(BO(3))(2) and K(3)Ln(BO(3))(2) would be stable, 
      density functional theory was used to calculate their enthalpies of formation, 
      which are favorable.
FAU - Hines, Adrian T
AU  - Hines AT
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Chemistry and Biochemistry, University of South Carolina, Columbia, 
      South Carolina 29208, United States.
FAU - Morrison, Gregory
AU  - Morrison G
AUID- ORCID: 0000-0001-9674-9224
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Chemistry and Biochemistry, University of South Carolina, Columbia, 
      South Carolina 29208, United States.
FAU - Tisdale, Hunter B
AU  - Tisdale HB
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Chemistry and Biochemistry, University of South Carolina, Columbia, 
      South Carolina 29208, United States.
FAU - Smith, Mark D
AU  - Smith MD
AD  - Department of Chemistry and Biochemistry, University of South Carolina, Columbia, 
      South Carolina 29208, United States.
FAU - Besmann, Theodore M
AU  - Besmann TM
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Mechanical Engineering, University of South Carolina, Columbia, 
      South Carolina 29208, United States.
FAU - Mofrad, Amir
AU  - Mofrad A
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Mechanical Engineering, University of South Carolina, Columbia, 
      South Carolina 29208, United States.
FAU - Aziziha, Mina
AU  - Aziziha M
AUID- ORCID: 0000-0003-4001-6413
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Mechanical Engineering, University of South Carolina, Columbia, 
      South Carolina 29208, United States.
FAU - Booth, Ronald E
AU  - Booth RE
AUID- ORCID: 0000-0003-3080-9145
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Mechanical Engineering, University of South Carolina, Columbia, 
      South Carolina 29208, United States.
FAU - Sun, Kai
AU  - Sun K
AUID- ORCID: 0000-0003-1745-9136
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Materials Science and Engineering, University of Michigan, Ann 
      Arbor, Michigan 48109, United States.
FAU - Was, Gary S
AU  - Was GS
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Nuclear Engineering and Radiological Sciences, University of 
      Michigan, Ann Arbor, Michigan 48109, United States.
FAU - Zur Loye, Hans-Conrad
AU  - Zur Loye HC
AUID- ORCID: 0000-0001-7351-9098
AD  - Center for Hierarchical Waste Form Materials, Columbia, South Carolina 29208, 
      United States.
AD  - Department of Chemistry and Biochemistry, University of South Carolina, Columbia, 
      South Carolina 29208, United States.
LA  - eng
PT  - Journal Article
DEP - 20220710
PL  - United States
TA  - Inorg Chem
JT  - Inorganic chemistry
JID - 0366543
SB  - IM
EDAT- 2022/07/12 06:00
MHDA- 2022/07/12 06:01
CRDT- 2022/07/11 05:03
PHST- 2022/07/12 06:00 [pubmed]
PHST- 2022/07/12 06:01 [medline]
PHST- 2022/07/11 05:03 [entrez]
AID - 10.1021/acs.inorgchem.2c01301 [doi]
PST - ppublish
SO  - Inorg Chem. 2022 Jul 25;61(29):11232-11242. doi: 10.1021/acs.inorgchem.2c01301. 
      Epub 2022 Jul 10.