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Computational Prediction of Ferro- and Piezoelectricity in Lead-Free Oxyhydrides Ln2H4O (Ln = Y, La)

Pishtshev, Aleksandr; Strugovshchikov, Evgenii (2019). <p>Computational Prediction of Ferro- and Piezoelectricity in Lead-Free Oxyhydrides Ln<sub>2</sub>H<sub>4</sub>O (Ln = Y, La)</p>. Advanced Theory and Simulations, 2, ARTN 1900144.10.1002/adts.201900144.
ajakirjaartikkel
Pishtshev, Aleksandr; Strugovshchikov, Evgenii
  • Inglise
<p>Computational Prediction of Ferro- and Piezoelectricity in Lead-Free Oxyhydrides Ln<sub>2</sub>H<sub>4</sub>O (Ln = Y, La)</p>
Advanced Theory and Simulations
WEINHEIM
2513-0390
2
2019
ARTN 1900144
9
Ilmunud
1.1. Teadusartiklid, mis on kajastatud Web of Science andmebaasides Science Citation Index Expanded, Social Sciences Citation Index, Arts & Humanities Citation Index ja/või andmebaasis Scopus (v.a. kogumikud)
WOS

Viited terviktekstile

doi.org/10.1002/adts.201900144

Lisainfo

Article
density functional theory; ferroelectric; first-principles modeling; mixed-anion compounds; piezoelectric; structure-property relationships