Showing 1–20 of 68 results
/ Date/ Name
Oct 25, 2008Band structure of tetragonal and orthorhombic fluorine-arsenide SrFeAsF as a parent phases for a new group of oxygen-free FeAs superconductorsApr 17, 2009Electronic properties of superconducting Sr4V2Fe2As2O6 versus Sr4Sc2Fe2As2O6Mar 31, 2009Structural, electronic and magnetic properties of ether carbides (Fe3W3C, Fe6W6C, Co3W3C and Co6W6C) from first principles calculationsMay 14, 2009Trends in structural and electronic properties for layered SrRu2As2, BaRu2As2, SrRh2As2 and BaRh2As2 from ab initio calculationsOct 14, 2009Electronic properties of novel 6K superconductor LiFePAug 2, 2010First-Principles Prediction of Novel Magnetic Materials Based on ZrCuSiAs-like Semiconducting Pnictide-OxidesApr 18, 2011New ternary ThCr2Si2-type iron-selenide superconducting materials: synthesis, properties and simulationsApr 18, 2011Electronic band structure and inter-atomic bonding in layered 1111-like Th-based pnictide oxides ThCuPO, ThCuAsO, ThAgPO, and ThAgAsO from first principles calculationsAug 8, 2012Electronic band structure, Fermi surface and effect of spin-orbit coupling for tetragonal low-temperature superconductor Bi2Pd from first principlesNov 16, 2012Electronic band structure and Fermi surface for new layered superconductor LaO0.5F0.5BiS2 in comparison with parent phase LaOBiS2 from first principlesDec 2, 2009Electronic band structure of novel tetragonal BiOCuS as a parent phase for novel layered superconductorsMay 13, 2008Electronic structure and magnetism in BeO nanotubes induced by boron, carbon and nitrogen impuritiesJun 3, 2010Elastic properties of superconducting MAX phases from first principles calculationsOct 13, 2010Atomic structure and electronic properties of nanotubes of layered iron-based superconductorsAug 27, 2012Fluorographynes: Stability, Structural and Electronic PropertiesFeb 16, 2011Elastic properties and inter-atomic bonding in new superconductor KFe2Se2 from first principles calculationsMar 31, 2009Electronic properties of hexagonal tungsten monocarbide WC with 3d impurities from first-principles calculationsMar 24, 2009Band structure of new layered 17 K superconductor Sr4Sc2Fe2P2O6 in comparison with hypothetical Sr4Sc2Fe2As2O6Jan 20, 2010Stability, structural, elastic and electronic properties of RuN polymorphs from first-principles calculationsApr 7, 2010Electronic and elastic properties of the new 7.5K superconductor Nb2InC from first principles