Search results for "density of states"
showing 10 items of 186 documents
Influence of the intermediate density-of-states occupancy on open-circuit voltage of bulk heterojunction solar cells with different fullerene accepto…
2010
Electron density of states (DOS) and recombination kinetics of bulk heterojunction solar cells consisting of a poly(3-hexylthiophene) (P3HT) donor and two fullerene acceptors, either [6,6]-phenyl-C61-butyric acid methyl ester (PCBM) or 4,4′-dihexyloxydiphenylmethano[60]fullerene (DPM6), have been determined by means of impedance spectroscopy. The observed difference of 125 mV in the output open-circuit voltage is attributed to significant differences of the occupancy of the DOS in both fullerenes. Whereas DPM6 exhibits a full occupation of the electronic band, occupancy is restricted to the tail of the DOS in the case of PCBM-based devices, implying a higher rise of the Fermi level in the D…
First principles calculations of oxygen vacancy formation and migration in mixed conducting Ba0.5Sr0.5Co1−yFeyO3−δ perovskites
2011
Abstract First-principles supercell calculations of oxygen vacancies in the Ba 0.5 Sr 0.5 Co 1− y Fe y O 3− δ (BSCF) perovskites are presented. The density of states is determined for different iron content and oxygen vacancy concentrations, and the characteristic differences for Co and Fe are discussed. We analyze the dependences of the defect (oxygen vacancy) formation and migration energies on the Fe content and compare the calculated properties with those of related LaCoO 3 and LaFeO 3 perovskites.
Structural, electronic, and magnetic properties of pseudomorphic CrFe nanostripes on W(110)
2007
We have grown pseudomorphic binary ${\mathrm{Cr}}_{1\ensuremath{-}x}{\mathrm{Fe}}_{x}$ alloy monolayers and sequences of Cr and Fe nanostripes on W(110) by molecular-beam epitaxy in ultrahigh vacuum. By coadsorption of Cr and Fe a pseudomorphic random CrFe alloy grows on the W(110) substrate. At a substrate temperature of $700\phantom{\rule{0.3em}{0ex}}\mathrm{K}$ the CrFe alloy forms monolayer stripes in the step flow growth mode. We have measured magnetic properties of the monolayer alloy for $0.75\ensuremath{\leqslant}x\ensuremath{\leqslant}1$ using Kerr magnetometry. At a constant relative temperature $t=T∕{T}_{C}$ the saturation value of the Kerr rotation shows a maximum at $x=0.95$ an…
Charge transfer and tunable minority band gap at the Fermi energy of a quaternaryCo2(MnxTi1−x)GeHeusler alloy
2010
We investigate the distribution of element-specific magnetic moments and changes in the spin-resolved unoccupied density of states in a series of half-metallic ${\text{Co}}_{2}({\text{Mn}}_{x}{\text{Ti}}_{1\ensuremath{-}x})\text{Ge}$ Heusler alloys using x-ray magnetic circular dichroism. The Co and Mn magnetic moments are oriented parallel while a small Ti moment shows antiparallel to the mean magnetization. The element-specific magnetic moments remain almost independent on the composition. Therefore, a replacement of Ti by Mn results in an increase in magnetization. The increase in magnetization with increasing $x$ follows the Slater-Pauling rule. The Fermi level decreases with respect to…
Subwavelength mapping of surface photonic states
2003
We show that the spectral tailoring of optical local density of states (LDOS) may be achieved by lithographically designed nanostructures and that the subwavelength mapping of the spectral variation of the optical LDOS is feasible by varying the driving frequency of the effective dipole used in an illumination mode scanning near-field optical microscope.
The Single Molecule Probe: Nanoscale Vectorial Mapping of Photonic Mode Density in a Metal Nanocavity
2009
International audience; We use superresolution single-molecule polarization and lifetime imaging to probe the local density of states (LDOS) in a metal nanocavity. Determination of the orientation of the molecular transition dipole allows us to retrieve the different LDOS behavior for parallel and perpendicular orientations with respect to the metal interfaces. For the perpendicular orientation, a strong lifetime reduction is observed for distances up to 150 nm from the cavity edge due to coupling to surface plasmon polariton modes in the metal. Contrarily, for the parallel orientation we observe lifetime variations resulting from coupling to characteristic λ/2 cavity modes. Our results are…
Low-Temperature Coherent Thermal Conduction in Thin Phononic Crystal Membranes
2016
In recent years, the idea of controlling phonon thermal transport coherently using phononic crystals has been introduced. Here, we extend our previous numerical studies of ballistic low-temperature heat transport in two-dimensional hole-array phononic crystals, and concentrate on the effect of the lattice periodicity. We find that thermal conductance can be either enhanced or reduced by large factors, depending on the the lattice period. Analysis shows that both the density of states and the average group velocity are strongly affected by the periodic structuring. The largest effect for the reduction seen for larger period structures comes from the strong reduction of the group velocities, …
Cathodic electrodeposition of ZnCoO thin films
2008
We report on the characterization of ternary Zn1–xCoxO alloy crystalline films grown by electrodeposition onto FTO-coated substrates. The Zn1–xCoxO films have hexagonal wurtzite structure as shown by X-ray diffraction measurements. The Co incorporation into the ZnO lattice is confirmed by the presence of absorption peaks assigned to Co in trigonal crystal field. X-ray photoemission spectroscopy indicates that as-grown films have a considerable concentration of not-fully oxidized metallic Co in the surface that correlates with the O concentration in the surface. Finally, Raman measurements of as-grown films indicate that they are polycrystalline with grains of nanometric size showing short-r…
Electronic structure of delta-doped $La:SrTiO_{3}$ layers by hard X-ray photoelectron spectroscopy
2012
We have employed hard x-ray photoemission (HAXPES) to study a delta-doped SrTiO3 layer that consisted of a 3-nm thickness of La-doped SrTiO3 with 6% La embedded in a SrTiO3 film. Results are compared to a thick, uniformily doped La:SrTiO3 layer. We find no indication of a band offset for the delta-doped layer, but evidence of the presence of Ti3+ in both the thick sample and the delta-layer, and indications of a density of states increase near the Fermi energy in the delta-doped layer. These results further demonstrate that HAXPES is a powerful tool for the non-destructive investigation of deeply buried doped layers.
First Principles Modeling of Pd-doped (La,Sr)(Co,Fe)O3Complex Perovskites
2016
(La,Sr)(Co,Fe)O3 (LSCF) perovskites are well known promising materials for cathodes of solid oxide fuel cells. In order to reduce cathode operational temperature, doping on B-sublattice with different metals was suggested. Indeed, as it was shown recently experimentally, doping with low Pd content increases oxygen vacancy concentration which is one of factors controlling oxygen transport in fuel cells. In this Communication, we modeled this material using first principles DFT calculations combined with supercell model. The charge density redistribution, density of states, and local lattice distortion around palladium ions are analyzed and reduction of the vacancy formation energy confirmed.