| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1506849 | Solid State Sciences | 2008 | 6 Pages |
Abstract
Crystal structure of the vaterite-type orthoborate YBO3 is investigated from the chemical bond viewpoint. Ligand-to-metal charge transfer energies of YBO3:Eu have been predicted based on the two probable space groups. The calculation of the charge transfer energy favors the structure suggested by Lin et. al. in which the YBO3 has the space group C2/c. Coordinating atoms of Y1 and Y2 in the crystal YBO3 with the space group C2/c are represented as following:
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Physical Sciences and Engineering
Materials Science
Ceramics and Composites
Authors
Ling Li, Shihong Zhou, Siyuan Zhang,