Matches in SemOpenAlex for { <https://semopenalex.org/work/W2057005406> ?p ?o ?g. }
Showing items 1 to 70 of
70
with 100 items per page.
- W2057005406 endingPage "16" @default.
- W2057005406 startingPage "9" @default.
- W2057005406 abstract "Abstract The electronic structure and optical properties of K2SrCdSb2 and K2BaCdSb2 compounds are computed using the full potential linearized augmented plane wave (FP-LAPW) method as implemented in WIEN2k code. In this perspective, the local density approximation (LDA), generalized gradient approximation (GGA) and Engel and Vosko approximation (EV-GGA) were used for the exchange correlation potential. The calculated band structure shows a direct band gap of about 0.344/0.20 eV (LDA), 0.463/0.285 eV (GGA) and 0.904/0.707 eV (EV-GGA) for K2SrCdSb2/K2BaCdSb2 compounds. The part of different bands was scrutinized from total and partial density of states curves. There is strong hybridization between Sr-s and Sr-p states and also between Cd-d and Sb-s states in the valence band. The electronic charge density has also been studied in the (200) crystallographic plane. The K, Sr/Ba, Cd and Sb atoms shows ionic bonding. Besides this, the optical properties, including the dielectric function are obtained and analyzed in details." @default.
- W2057005406 created "2016-06-24" @default.
- W2057005406 creator A5011852635 @default.
- W2057005406 creator A5012100524 @default.
- W2057005406 date "2015-05-01" @default.
- W2057005406 modified "2023-09-29" @default.
- W2057005406 title "Theoretical study of the new zintl phases compounds K2ACdSb2 (A=(Sr, Ba))" @default.
- W2057005406 cites W1480103658 @default.
- W2057005406 cites W1534448752 @default.
- W2057005406 cites W1551846171 @default.
- W2057005406 cites W1607286065 @default.
- W2057005406 cites W1964060380 @default.
- W2057005406 cites W1981368803 @default.
- W2057005406 cites W1983205058 @default.
- W2057005406 cites W1984372233 @default.
- W2057005406 cites W1992961393 @default.
- W2057005406 cites W2011721578 @default.
- W2057005406 cites W2014898052 @default.
- W2057005406 cites W2022761082 @default.
- W2057005406 cites W2026907619 @default.
- W2057005406 cites W2030976617 @default.
- W2057005406 cites W2046324350 @default.
- W2057005406 cites W2049301745 @default.
- W2057005406 cites W2055662237 @default.
- W2057005406 cites W2060671558 @default.
- W2057005406 cites W2088925839 @default.
- W2057005406 cites W2089681190 @default.
- W2057005406 cites W2093961771 @default.
- W2057005406 cites W2110875966 @default.
- W2057005406 cites W2148596493 @default.
- W2057005406 cites W2151108094 @default.
- W2057005406 cites W2319981223 @default.
- W2057005406 cites W2949895578 @default.
- W2057005406 cites W2950397810 @default.
- W2057005406 cites W3023127551 @default.
- W2057005406 doi "https://doi.org/10.1016/j.physb.2015.02.010" @default.
- W2057005406 hasPublicationYear "2015" @default.
- W2057005406 type Work @default.
- W2057005406 sameAs 2057005406 @default.
- W2057005406 citedByCount "0" @default.
- W2057005406 crossrefType "journal-article" @default.
- W2057005406 hasAuthorship W2057005406A5011852635 @default.
- W2057005406 hasAuthorship W2057005406A5012100524 @default.
- W2057005406 hasConcept C185592680 @default.
- W2057005406 hasConcept C192562407 @default.
- W2057005406 hasConcept C8010536 @default.
- W2057005406 hasConceptScore W2057005406C185592680 @default.
- W2057005406 hasConceptScore W2057005406C192562407 @default.
- W2057005406 hasConceptScore W2057005406C8010536 @default.
- W2057005406 hasFunder F4320335322 @default.
- W2057005406 hasLocation W20570054061 @default.
- W2057005406 hasOpenAccess W2057005406 @default.
- W2057005406 hasPrimaryLocation W20570054061 @default.
- W2057005406 hasRelatedWork W1531601525 @default.
- W2057005406 hasRelatedWork W1990781990 @default.
- W2057005406 hasRelatedWork W2314643286 @default.
- W2057005406 hasRelatedWork W2606768298 @default.
- W2057005406 hasRelatedWork W2606769243 @default.
- W2057005406 hasRelatedWork W2606837276 @default.
- W2057005406 hasRelatedWork W2748952813 @default.
- W2057005406 hasRelatedWork W2899084033 @default.
- W2057005406 hasRelatedWork W2948807893 @default.
- W2057005406 hasRelatedWork W2778153218 @default.
- W2057005406 hasVolume "464" @default.
- W2057005406 isParatext "false" @default.
- W2057005406 isRetracted "false" @default.
- W2057005406 magId "2057005406" @default.
- W2057005406 workType "article" @default.