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Published in 2020 at "Physical Review B"
DOI: 10.1103/physrevb.101.205120
Abstract: We apply the quasiparticle self-consistent GW method (QSGW) to slab models of ionic materials, LiF, KF, NaCl, MgO, and CaO, under electric field. Then we obtain the optical dielectric constants E(Slab) from the differences of…
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Keywords:
vertex correction;
consistent method;
electric field;
quasiparticle self ... See more keywords
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recommendations!
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Published in 2017 at "Physical Review B"
DOI: 10.1103/physrevb.96.205206
Abstract: The GW self-energy method has long been recognized as the gold standard for quasiparticle (QP) calculations of solids in spite of the fact that the neglect of vertex corrections and the use of a DFT…
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Keywords:
correction improves;
band gap;
simple vertex;
vertex correction ... See more keywords