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Alkali Metal (Li, Na, and K) Orthocarbonates: Stabilization of sp3-Bonded Carbon at Pressures above 20 GPa
- Source :
- Crystal Growth & Design. 21:6744-6751
- Publication Year :
- 2021
- Publisher :
- American Chemical Society (ACS), 2021.
-
Abstract
- In the present work, based on the density functional theory and crystal structure prediction algorithms, we found novel structures of alkali metal orthocarbonates Li4CO4-C2/c, Na4CO4-C2/c, and K4CO...
Details
- ISSN :
- 15287505 and 15287483
- Volume :
- 21
- Database :
- OpenAIRE
- Journal :
- Crystal Growth & Design
- Accession number :
- edsair.doi...........3cef1977d8b19b14c4997a9b4946882f
- Full Text :
- https://doi.org/10.1021/acs.cgd.1c00652