Theoretical prediction by DFT on properties of β′-SrTa2O6 crystal
Based on the Density Functional Theory (DFT) electronic band structure, state density, linear optics, elastic, dynamic and thermodynamic properties of β′-SrTa2O6 crystal with P4/mbm (No. 127) space group were investigated with the help of ABINIT and Wien2k code. In the study, it was found that the β...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
University of Novi Sad
2023-03-01
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| Series: | Processing and Application of Ceramics |
| Subjects: | |
| Online Access: | https://www.doiserbia.nb.rs/img/doi/1820-6131/2023/1820-61312301001A.pdf |