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Prediction of high-pressure phases of Weyl semimetal NbAs and NbP

As the first known Weyl semimetals, binary compounds including TaP, TaAs, NbAs, and NbP have received worldwide interest. This work explored the phase behaviours of NbAs and NbP under high pressure up to 200 GPa via first-principles calculations combined with intelligent particle swarm optimization....

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Bibliographic Details
Published in:Sci Rep
Main Authors: Zhang, Jingyun, Yang, Cuihong, Rao, Weifeng, Hao, Jian, Li, Yinwei
Format: Artigo
Language:Inglês
Published: Nature Publishing Group UK 2017
Subjects:
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC5643394/
https://ncbi.nlm.nih.gov/pubmed/29038565
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-017-13610-x
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