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Ab initio calculations based on the density-functional pseudopotential approach have been used to study the fully relaxed structure, the electron distribution and the electronic density of states of (001) terraces, steps, corners and…

mtrl-th · Physics 2009-10-28 L. N. Kantorovich , J. M. Holender , M. J. Gillan

We present a microscopic investigation of frequently observed impurity-induced states in stoichiometric LiFeAs using low temperature scanning tunneling microscopy and spectroscopy (STM/STS). Our data reveal seven distinct well defined…

Superconductivity · Physics 2018-06-12 R. Schlegel , P. K. Nag , D. Baumann , R. Beck , S. Wurmehl , B. Büchner , C. Hess

The effect of impurities on a superconductor with Bogoliubov Fermi surfaces (BFSs) is studied using a realistic tight-binding model. Based on the band structure composed of $d$-orbitals in tetragonal FeSe, whose S-doped sample is a…

Superconductivity · Physics 2025-10-07 Tatsuya Miki , Hiroaki Ikeda , Shintaro Hoshino

We performed a combined angle-resolved photoemission spectroscopy and scanning tunneling microscopy study of the electronic structure of electron-doped Ca$_{0.83}$La$_{0.17}$Fe$_2$As$_2$. A surface reconstruction associated with the…

Superconductivity · Physics 2013-01-08 Y. -B. Huang , P. Richard , J. -H. Wang , X. -P. Wang , X. Shi , N. Xu , Z. Wu , A. Li , J. -X. Yin , T. Qian , B. Lv , C. W. Chu , S. H. Pan , M. Shi , H. Ding

We present a combined experimental and theoretical study of the evolution of the Fermi surface of the anomalous superconductor Pb$_{1-x}$Tl$_x$Te as a function of thallium concentration, drawing on a combination of magnetotransport…

We study the properties of the impurity band in heavily-doped non-magnetic semiconductors using the Jacobi-Davidson algorithm and the supervised deep learning method. The disorder averaged inverse participation ratio (IPR) and thouless…

Disordered Systems and Neural Networks · Physics 2023-01-18 Hongwei Chen , Zi-Xiang Hu

We investigate single Fe and Co atoms buried below a Cu(100) surface using low temperature scanning tunneling spectroscopy. By mapping the local density of states of the itinerant electrons at the surface, the Kondo resonance near the Fermi…

Mesoscale and Nanoscale Physics · Physics 2012-04-24 Henning Prüser , Martin Wenderoth , Alexander Weismann , Rainer G. Ulbrich

We explore theoretically the density of states (LDOS) probed by an STM tip of 2D systems hosting an adatom and a subsurface impurity,both capacitively coupled to AFM tips and traversed by antiparallel magnetic fields. Two kinds of setups…

Strongly Correlated Electrons · Physics 2014-03-27 A. C. Seridonio , E. C. Siqueira , F. M. Souza , R. S. Machado , S. S. Lyra , I. A. Shelykh

We use density functional theory calculations to characterize the early stages of fluorination of silver's (100) and (110) surfaces. In the Ag(100) surface, the hollow site is the most favorable for F adatoms. In the Ag(110) surface, three…

High-density structures of sub-surface phosphorus dopants in silicon continue to garner interest as a silicon-based quantum computer platform, however, a much-needed confirmation of their dopant arrangement has been lacking. In this work,…

Electronic density of states (DOS) at Fermi level has been investigated in ultrathin Ag films grown on Si(111)-(7x7) down to the two dimensional limit of a single atomic layer. Measurement of DOS at Fermi level by scanning tunneling…

Mesoscale and Nanoscale Physics · Physics 2014-12-04 R. Batabyal , A. H. M. Abdul Wasey , J. C. Mahato , Debolina Das , G. P. Das , B. N. Dev

The electronic structure of electron-doped polycrystalline Mg$_{1-x}$Al$_{x}$(B$_{1-y}$C$_{y}$)$_2$ was examined by electron energy-loss spectroscopy (EELS) in a scanning transmission electron microscope (STEM) and first-principle…

Superconductivity · Physics 2007-05-23 R. F. Klie , J. C. Zheng , Y. Zhu , A. J. Zambano , L. D. Cooley

The electronic properties of epitaxial heterojunctions consisting of the prototypical perovskite oxide semiconductor,n-SrTiO3 and the high-mobility Group IV semiconductor p-Ge have been investigated. Hard x-ray photoelectron spectroscopy…

Phosphorus diffusion on a Si(100) surface was studied using scanning tunneling microscopy (STM) at temperatures of 77 and 300 K. The phosphorus source utilized was the PBr$_3$ molecule, which fully dissociates on the surface at 77 K. We…

Materials Science · Physics 2025-10-20 T. V. Pavlova , V. M. Shevlyuga

Superperiodic patterns near a step edge were observed by STM on several-layer-thick graphite sheets on a highly oriented pyrolitic graphite substrate, where a dislocation network is generated at the interface between the graphite overlayer…

High resolution photoemission measurements have been carried out on non-superconducting SmOFeAs parent compound and superconducting Sm(O$_{1-x}$F$_x$)FeAs (x=0.12, and 0.15) compounds. The momentum-integrated spectra exhibit a clear Fermi…

Recent advances in the characterization of hexagonal-diamond silicon (2H-Si) have shown that this material possesses remarkably different structural, electronic, and optical properties as compared to the common cubic-diamond (3C) polytype.…

Materials Science · Physics 2024-10-22 Marc Túnica , Alberto Zobelli , Michele Amato

First principles total-energy pseudopotential calculations have been performed to investigate STM images of the (110) cross-sectional surface of Mn-doped GaAs. We have considered configurations with Mn in interstitial positions in the…

Materials Science · Physics 2007-05-23 A. Stroppa

Scanning tunneling microscopy (STM) measurements have been extensively performed on the easily cleavable (011) surface of UTe$_2$, using both normal-metal and superconducting tips. Motivated by these experiments, we theoretically…

Superconductivity · Physics 2026-03-09 Jushin Tei , Takeshi Mizushima , Satoshi Fujimoto

The effect of a nonmagnetic impurity on the subgap electronic spectrum in a d-wave superconductor in the Fulde-Ferrell-Larkin-Ovchinnikov state is investigated. In a pure system, the spatial variation of the order parameter (OP) of the FFLO…

Superconductivity · Physics 2007-05-23 Qian Wang , Chia-Ren Hu , Chin-Sen Ting