High pressure studies of sc based ternary system: a DFT study
Author:
Publisher
Springer Science and Business Media LLC
Subject
Electrical and Electronic Engineering,Atomic and Molecular Physics, and Optics,Electronic, Optical and Magnetic Materials
Link
https://link.springer.com/content/pdf/10.1007/s11082-023-05505-1.pdf
Reference27 articles.
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2. Akopov, G., Yin, H., Roh, I., Pangilinan, L.E., Kaner, R.B.: Investigation of hardness of Ternary Borides of the YCrB4, Y2ReB6, Y3ReB7 and YMo3B7 structural types. Chem. Mater. 30, 6494–6502 (2018b)
3. Ceperley, D.M., Alder, B.J.: Ground State of the Electron gas by a Stochastic Method. Phys. Rev. Lett. 45, 566–569 (2005)
4. Clark, S.J., Segall, M.D., Pickard, C.J., Hasnip, P.J., Probert, M.I.J., Refson, K., Payne, M.C.: First principles methods using CASTEP. Z. Krist. Cryst. Mater. 220, 567–570 (2005). https://doi.org/10.1524/zkri.220.5.567.65075
5. Fischer, T.H., Almlof, J.: General methods for geometry and wave function optimization. J. Phys. Chem. 96, 9768–9774 (1992). https://doi.org/10.1021/j100203a036
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