Electronic structure analysis of the quasi-one-dimensional oxide Sr6Co5O15 within the LDA+U method

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Sánchez Botana, Antía; Botta, P. M.; Calle, C. de la; Piñeiro Guillén, Ángel; Pardo Castro, Víctor; Botana Alcalde, Jorge; Pereiro López, Manuel; Baldomir Fernández, Daniel; Alonso Moral, José María; Arias, J. E.;
(2011)
  • Publisher: American Institute Of Physics
  • Related identifiers: doi: 10.1063/1.3536796
  • Subject: CARBON DIOXIDE | BOLTZMANN EQUATIONS | LASER DOPPLER VELOCIMETRY | FIRST-PRINCIPLES CALCULATIONS | Ciencias Físicas | ELECTRONIC STRUCTURE | COBALTITE | Física de los Materiales Condensados | TRANSPORT PROPERTIES | CIENCIAS NATURALES Y EXACTAS

The quasi-one-dimensional cobalt oxide Sr6Co5O15 is studied using first-principles electronic-structure calculations and Boltzmann transport theory. We have been able to describe the electronic structure, characterized by the structural one-dimensionality and a particul... View more