Phase Change Observed in Ultrathin Ba0.5Sr0.5TiO3 Films by in-situ Resonant Photoemission Spectroscopy

Epitaxial Ba0.5Sr0.5TiO3 thin films were prepared on Nb-doped SrTiO3 (100)substrates by the pulsed laser deposition technique, and were studied by measuring the Ti 2p - 3d resonant photoemission spectra in the valence-band region as a function of film thickness, both at room temperature and low temperature. Our results demonstrated an abrupt variation in the spectral structures between 2.8 nm (~7 monolayers) and 2.0 nm (~5 monolayers) Ba0.5Sr0.5TiO3 films, suggesting that there exists a critical thickness for phase change in the range of 2.0 nm to 2.8 nm. This may be ascribed mainly to the intrinsic size effects.Comment: 13 pages, 4 figure

Electronic structure of spinel-type LiV_2O_4

The band structure of the cubic spinel compound LiV_2O_4, which has been reported recently to show heavy Fermion behavior, has been calculated within the local-density approximation using a full-potential version of the linear augmented-plane-wave method. The results show that partially-filled V 3d bands are located about 1.9 eV above the O 2p bands and the V 3d bands are split into a lower partially-filled t_{2g} complex and an upper unoccupied e_{g} manifold. The fact that the conduction electrons originate solely from the t_{2g} bands suggests that the mechanism for the mass enhancement in this system is different from that in the 4f heavy Fermion systems, where these effects are attributed to the hybridization between the localized 4f levels and itinerant spd bands.Comment: 5 pages, revte

Two-Fermi-surface superconducting state and a nodal d-wave gap in the electron-doped Sm(1.85)Ce(0.15)CuO(4-d) cuprate superconductor

We report on laser-excited angle-resolved photoemission spectroscopy (ARPES) in the electron-doped cuprate Sm(1.85)Ce(0.15)CuO(4-d). The data show the existence of a nodal hole-pocket Fermi-surface both in the normal and superconducting states. We prove that its origin is long-range antiferromagnetism by an analysis of the coherence factors in the main and folded bands. This coexistence of long-range antiferromagnetism and superconductivity implies that electron-doped cuprates are two-Fermi-surface superconductors. The measured superconducting gap in the nodal hole-pocket is compatible with a d-wave symmetry.Comment: 4 pages, 3 figures, accepted to Phys. Rev. Let

Orbital Symmetry and Electron Correlation in Na_{x}CoO_2

Measurements of polarization-dependent soft x-ray absorption reveal that the electronic states determining the low-energy excitations of Na$_{x}$CoO$_2$ have predominantly $a_{1g}$ symmetry with significant O $2p$ character. A large transfer of spectral weight observed in O $1s$ x-ray absorption provides spectral evidence for strong electron correlations in the layered cobaltates. Comparing Co $2p$ x-ray absorption with calculations based on a cluster model, we conclude that Na$_{x}$CoO$_2$ exhibits a charge-transfer electronic character rather than a Mott-Hubbard character

Spectral functions for strongly correlated 5f-electrons

We calculate the spectral functions of model systems describing 5f-compounds adopting Cluster Perturbation Theory. The method allows for an accurate treatment of the short-range correlations. The calculated excitation spectra exhibit coherent 5f bands coexisting with features associated with local intra-atomic transitions. The findings provide a microscopic basis for partial localization. Results are presented for linear chains.Comment: 10 Page

Electronic structure of NiS_{1-x}Se_x

We investigate the electronic structure of the metallic NiS$_{1-x}$Se$_x$ system using various electron spectroscopic techniques. The band structure results do not describe the details of the spectral features in the experimental spectrum, even for this paramagnetic metallic phase. However, a parameterized many-body multi-band model is found to be successful in describing the Ni~2$p$ core level and valence band, within the same model. The asymmetric line shape as well as the weak intensity feature in the Ni~2$p$ core level spectrum has been ascribed to extrinsic loss processes in the system. The presence of satellite features in the valence band spectrum shows the existence of the lower Hubbard band, deep inside the $pd$ metallic regime, consistent with the predictions of the dynamical mean field theory.Comment: To be published in Physical Review B, 18 pages and 5 figure

Disorder Effects in the Bipolaron System Ti4_{4}O7_{7} Studied by Photoemission Spectroscopy

We have performed a photoemission study of Ti$_{4}$O$_{7}$ around its two transition temperatures so as to cover the metallic, high-temperature insulating (bipolaron-liquid), and low-temperature insulating (bipolaron-crystal) phases. While the spectra of the low-temperature insulating phase show a finite gap at the Fermi level, the spectra of the high-temperature insulating phase are gapless, which is interpreted as a soft Coulomb gap due to dynamical disorder. We suggest that the spectra of the high-temperature disordered phase of Fe$_{3}$O$_{4}$, which exhibits a charge order-disorder transition (Verwey transition), can be interpreted in terms of a Coulomb gap.Comment: 4 pages, 3 epsf figures embedde