Concepedia

Thermoelectric properties of n-type half-Heusler NbCoSn with heavy-element Pt substitution

Federico Serrano‐Sánchez, Ting Luo, Junjie Yu, Wenjie Xie, Congcong Le, Gudrun Auffermann, Anke Weidenkaff, Tiejun Zhu, Xinbing Zhao, J. A. Alonso,

Journal of Materials Chemistry A · 2020 · 68 citations · 49 references

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Abstract

Heavy-element Pt substitution and post-annealing promote the thermoelectric performance enhancement of n-type NbCoSn half-Heusler compound.

References

49

Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

Georg Kresse, J. Furthmüller · Physical review. B, Condensed matter · 1996 · 120.5K citations

, , +15

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

Georg Kresse, J. Furthmüller · Computational Materials Science · 1996 · 74.7K citations

, , +14

Special points for Brillouin-zone integrations

Hendrik J. Monkhorst, J.D. Pack · Physical review. B, Solid state · 1976 · 70.3K citations

, , +6

<i>Ab initio</i>molecular dynamics for liquid metals

Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1993 · 44.9K citations

, , +17

A profile refinement method for nuclear and magnetic structures

H. M. Rietveld · Journal of Applied Crystallography · 1969 · 17.2K citations

, , +9