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Surface electronic structure and its one-dimensionality above and below the Fermi level ($E_{\rm F}$) were surveyed on the Bi/GaSb(110)-(2$\times$1) surface hosting quasi-one-dimensional (Q1D) Bi chains, using conventional (one-photon) and…

In this study, we report the observation of a pseudogap associated with the insulator-metal transition in compositions of Pr$_{1-x}$Sr$_x$MnO$_3$ system with no charge ordering. Our valence band photoemission study shows that the observed…

强关联电子 · 物理学 2008-05-06 P. Pal , M. K. Dalai , R. Kundu , M. Chakraborty , B. R. Sekhar , C. Martin

The full-potential linear augmented plane-wave calculations have been applied to investigate the systematic change of electronic structures in CaAlSi due to different stacking sequences of AlSi layers. The present ab-initio calculations…

超导电性 · 物理学 2009-11-13 S. Kuroiwa , A. Nakashima , S. Miyahara , N. Furukawa , J. Akimitsu

Using electron-induced X-ray emission spectroscopy (XES), we have studied two Al/Ni periodic multilayers that differ only by their annealing temperature: as-deposited and annealed at 115C. Our aim is to show that XES can provide further…

材料科学 · 物理学 2013-07-16 K. Le Guen , G. Gamblin , Philippe Jonnard , M. Salou , J. Ben Youssef , S. Rioual , B. Rouvellou

In this paper, we investigate the topological properties of ZrRuP and ScPd$_{3}$ using the first-principles calculations. We calculate the electronic structure, surface states, and Z$_{2}$ topological invariant. The band structure of ZrRuP…

材料科学 · 物理学 2018-01-10 Armindo S. Cuamba , Hong-Yan Lu , Lei Hao , C. S. Ting

We review a variety of theoretical and experimental results concerning electronic band structure of superconducting materials based on FeSe monolayers. Three type of systems are analyzed: intercalated FeSe systems A_xFe_2Se_{2-x}S_x and…

超导电性 · 物理学 2017-02-20 I. A. Nekrasov , N. S. Pavlov , M. V. Sadovskii , A. A. Slobodchikov

We report on the investigation of the atomic and electronic structures of a clean Si(331)-(12$\times$1) surface using a first-principles approach with both plane wave and strictly localized basis sets. Starting from the surface structure…

材料科学 · 物理学 2018-12-31 Ruslan Zhachuk , José Coutinho , Krisztián Palotás

The electronic structure of the heavy fermion compound CeB6 is probed by resonant inelastic soft X-ray scattering using photon energies across the Ce 3d and 4d absorption edges. The hybridization between the localized 4f orbitals and the…

材料科学 · 物理学 2012-01-04 M. Magnuson , S. M. Butorin , J. -H. Guo , A. Agui , J. Nordgren , H. Ogasawara , A. Kotani , T. Takahashi , S. Kunii

We have calculated electronic and optical properties of Si/BeSe$_{0.41}$Te$_{0.59}$ heterostructures by a semiempirical $sp^{3}s^{*}$ tight-binding method. Tight-binding parameters and band bowing of BeSe$_{0.41}$Te$_{0.59}$ are considered…

材料科学 · 物理学 2009-07-01 Titus Sandu W. P. Kirk

We report on total-energy electronic-structure calculations in the density-functional theory performed for both monolayer and bilayer silicene on Ag(111) surfaces. The rt3 x rt3 structure observed experimentally and argued to be the…

介观与纳米尺度物理 · 物理学 2014-04-15 Zhi-Xin Guo , Atsushi Oshiyama

Based on first-principles calculations of structure optimization, phonon modes and finite temperature molecular dynamics, we predict that silicon and germanium have stable, two-dimensional, low-buckled, honeycomb structures. Similar to…

材料科学 · 物理学 2010-05-20 Seymur Cahangirov , Mehmet Topsakal , Ethem Akturk , Hasan Sahin , Salim Ciraci

The dosing of layered materials with alkali metals has become a commonly used strategy in ARPES experiments. However, precisely what occurs under such conditions, both structurally and electronically, has remained a matter of debate. Here…

We develop a tight-binding model description of semi-Dirac electronic spectra, with highly anisotropic dispersion around point Fermi surfaces, recently discovered in electronic structure calculations of VO$_2$/TiO$_2$ nano-heterostructures.…

强关联电子 · 物理学 2015-05-13 S. Banerjee , R. R. P. Singh , V. Pardo , W. E. Pickett

Most recent observation of topological Fermi arcs on the surface of manyfold degenerate B20 systems, CoSi and RhSi, have attracted enormous research interests. Although an another isostructural system, FeSi, has been predicted to show bulk…

The structural, elastic, and electronic properties of the very recently discovered ternary silicide superconductor, Li2IrSi3, have been calculated using ab-initio technique. We have carried out the plane-wave pseudopotential approach within…

超导电性 · 物理学 2015-05-12 M. A. Hadi , M. A. Alam , M. Roknuzzaman , M. T. Nasir , A. K. M. A. Islam , S. H. Naqib

The spin texture of the metallic two-dimensional electron system (root3 x root3)-Au/Ge(111) is revealed by fully three-dimensional spin-resolved photoemission, as well as by density functional calculations. The large hexagonal Fermi…

We investigated the electronic structure of the Si(111)--7$\times$7 surface below 20 K by scanning tunneling and photoemission spectroscopies and by density functional theory calculations. Previous experimental studies have questioned the…

强关联电子 · 物理学 2021-04-20 S. Modesti , P. M. Sheverdyaeva , P. Moras , C. Carbone , M. Caputo , M. Marsi , E. Tosatti , G. Profeta

The electronic band structure and Fermi surface of ZrTe_3 was precisely determined by linearly polarized angle-resolved photoelectron spectroscopy. Several bands and a large part of the Fermi surface are found to be split by 100-200 meV…

强关联电子 · 物理学 2015-05-13 Moritz Hoesch , Xiaoyu Cui , Kenya Shimada , Corsin Battaglia , Shin-ichi Fujimori , Helmuth Berger

The electronic structure of spinel-type Cu_(1-x)Ni_xRh_2S_4 (x = 0.0, 0.1, 0.3, 0.5, 1.0) and CuRh_2Se_4 compounds has been studied by means of X-ray photoelectron and fluorescent spectroscopy. Cu L_3, Ni L_3, S L_(2,3) and Se M_(2,3) X-ray…

We present results of it ab initio LDA calculations of electronic structure of "next generation" layered ironpnictide High-Tc superconductor LiFeAs (Tc=18K). Obtained electronic structure of LiFeAs is very similar to recently studied…

超导电性 · 物理学 2009-11-13 I. A. Nekrasov , Z. V. Pchelkina , M. V. Sadovskii