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Many properties of layered materials change as they are thinned from their bulk forms down to single layers, with examples including indirect-to-direct band gap transition in 2H semiconducting transition metal dichalcogenides as well as…

We theoretically study the conductivity of a disordered 2D metal when it is coupled to ferromagnetic magnons with a quadratic spectrum and a gap $\Delta$. In the diffusive limit, a combination of disorder and magnon-mediated electron…

Strongly Correlated Electrons · Physics 2023-04-10 Joshua Aftergood , So Takei

We report accurate energetics of defects introduced in GaN on doping with divalent metals, focussing on the technologically important case of Mg doping, using a model which takes into consideration both the effect of hole localisation and…

Rate theory and DFT calculations of hydrogen evolution reaction (HER) on MoS2 with Co, Ni and Pt impurities show the significance of dihydrogen (H2*) complex where both hydrogen atoms are interacting with the surface. Stabilization of such…

Materials Science · Physics 2024-09-05 Sander Ø. Hanslin , Hannes Jónsson , Jaakko Akola

Electron conduction through bare metal oxide nanocrystal (NC) films is hindered by surface depletion regions resulting from the presence of surface states. We control the radial dopant distribution in tin-doped indium oxide (ITO) NCs as a…

The electronic properties of pentavalent-ion (Nb$^{5+}$, Ta$^{5+}$, and I$^{5+}$) doped anatase and rutile TiO$_2$ are studied using spin-polarized GGA+\emph{U} calculations. Our calculated results indicate that these two phases of TiO$_2$…

Materials Science · Physics 2015-05-13 Kesong Yang , Ying Dai , Baibiao Huang , Yuan Ping Feng

The quasi-two-dimensional nature of the charge carriers energy spectrum in layered conductors leads to specific effects in an external magnetic field. The magnetoresistance of layered conductors in a wide range of strong magnetic fields…

Statistical Mechanics · Physics 2010-06-09 O. V. Kirichenko , Yu. A. Kolesnichenko , V. G. Peschansky

We report AC-impedance studies on a series of high-quality LiMn$_{1-x}$Fe$_x$PO$_4$ single crystals with $0\leq x \leq 1$. Our results confirm quasi-one-dimensional transport in LiFePO$_4$ with fast Li-diffusion along the $b$-axis. The…

Materials Science · Physics 2020-12-17 Christoph Neef , Elisa Thauer , Andreas Reiser , Rüdiger Klingeler

The electronic response of doped manganites at the transition from the paramagnetic insulating to the ferromagnetic metallic state in $\rm La_{1-x}Ca_{x}MnO_3$ for $\rm (x=0.3,0.2)$ was investigated by dc conductivity, ellipsometry, and VUV…

Strongly Correlated Electrons · Physics 2016-08-14 A. Rusydi , R. Rauer , G. Neuber , M. Bastjan , I. Mahns , S. Müller , P. Saichu , B. Schulz , G. Stryganyuk , K. Dörr , G. A. Sawatzky , S. L. Cooper , M. Rübhausen

The prospects of phosphorene as an anode material for high performance Li-ion battery was systematically investigated from the first principle calculations and experimental measurements. The diffusion energy barriers of a Li atom moving…

Materials Science · Physics 2016-07-04 Congyan Zhang , George Anderson , Ruchira Ravinath Dharmasena , Gamini Sumanasekera , Ming Yu

Photoionization spectroscopy and mass spectrometry of doped helium (He) nanodroplets rely on the ability to efficiently detect ions and/or electrons. Using a commercial quadrupole mass spectrometer and a photoelectron-photoion coincidence…

Routes to enhance superconducting instability are explored for doped Mott insulators. With the help of insights for criticalities of metal-insulator transitions, geometrical design of lattice structure is proposed to control the…

Strongly Correlated Electrons · Physics 2009-10-31 Masatoshi Imada , Masanori Kohno

The moir\'e pattern induced by lattice mismatch in transition-metal dichalcogenide heterobilayers causes the formation of flat bands, where interactions dominate the kinetic energy. At fractional fillings of the flat valence band, the…

Strongly Correlated Electrons · Physics 2023-12-07 Yuting Tan , Pak Ki Henry Tsang , Vladimir Dobrosavljević , Louk Rademaker

The electronic and optical properties of self-trapped holes in kappa-phase orthorhombic Ga2O3 in conjunction with isoelectronic and acceptor dopants were studied using hybrid density functional theory. Hole trapping was found to be…

Materials Science · Physics 2026-05-18 Eric Welch , Nathan Rabelo Martins , Luisa Scolfaro , Luiz A. F. C. Viana , Pablo D. Borges

We have studied metal/organic semiconductor charge injection in poly(3-hexylthiophene) (P3HT) field-effect transistors with Pt and Au electrodes as a function of annealing in vacuum. At low impurity dopant densities, Au/P3HT contact…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 B. H. Hamadani , H. Ding , Y. Hao , D. Natelson

Bose-Fermi mixtures naturally appear in various physical systems. In semiconductor heterostructures, such mixtures can be realized, with bosons as excitons and fermions as dopant charges. However, the complexity of these hybrid systems…

We demonstrate that the differential conductance, $dI/dV$, measured via spectroscopic imaging scanning tunneling microscopy in the doped iron chalcogenide FeSe$_{0.45}$Te$_{0.55}$, possesses a series of characteristic features that allow…

Though most fermionic Mott insulators order at low temperatures, ordering is ancillary to their insulating behaviour. Our emphasis here is on disentangling ordering from the intrinsic strongly correlated physics of a doped half-filled band.…

Strongly Correlated Electrons · Physics 2009-11-10 Tudor D. Stanescu , Philip Phillips

Amorphous metal oxide thin-film transistors (TFT) are fabricated using InOx-based semiconductors doped with TiO2, WO3 or SiO2. Although density of dopant is low in the film, change in the electrical properties showed strong dependence on…

Materials Science · Physics 2013-10-25 Shinya Aikawa , Toshihide Nabatame , Kazuhito Tsukagoshi

The diffusion of Li in electrode materials is key factor to charging/discharging rate capacity of Li-ion battery (LIB). Recently, two-dimensional phosphorene has been proposed as a very promising electrode material due to its ultrafast and…

Materials Science · Physics 2015-09-08 Ruiqi Zhang , Xiaojun Wu , Jinlong Yang