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Ab initio study of lattice instabilities of zinc chalcogenides ZnX (X=O, S, Se, Te) induced by ultrafast intense laser irradiation
Ab initio calculations of lattice constants, lattice stabilities of ZnX (X=O, S, Se, Te) at different electronic temperatures (Te) have been performed using generalized gradient approximation (GGA) pseudopotential method within the density functional theory (DFT). The calculated phonon frequencies o...
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Hauptverfasser: | , , , , |
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Format: | Artigo |
Sprache: | Inglês |
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AIP Publishing LLC
2017-09-01
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Schriftenreihe: | AIP Advances |
Online Zugang: | http://dx.doi.org/10.1063/1.4999445 |
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