Search results for "MT"
showing 10 items of 2759 documents
Alternative Buffer-Layers for the Growth of SrBi2Ta2O9 on Silicon
2000
In this work we investigate the influence of the use of YSZ and CeO2/YSZ as insulators for Metal- Ferroelectric-Insulator-Semiconductor (MFIS) structures made with SrBi2Ta2O9 (SBT). We show that by using YSZ only the a-axis oriented Pyrochlore phase could be obtained. On the other hand the use of a CeO2/YSZ double-buffer layer gave a c-axis oriented SBT with no amorphous SiO2 inter- diffusion layer. The characteristics of MFIS diodes were greatly improved by the use of the double buffer. Using the same deposition conditions the memory window could be increased from 0.3 V to 0.9 V. From the piezoelectric response, nano-meter scale ferroelectric domains could be clearly identified in SBT thin…
Reliable magnetic domain wall propagation in cross structures for advanced multi-turn sensor devices
2017
We develop and analyze an advanced concept for domain wall based sensing of rotations. Moving domain walls in n closed loops with n-1 intersecting convolutions by rotating fields, we can sense n rotations. By combining loops with coprime numbers of rotations, we create a sensor system allowing for the total counting of millions of turns of a rotating applied magnetic field. We analyze the operation of the sensor and identify the intersecting cross structures as the critical component for reliable operation. In particular depending on the orientation of the applied field angle with the magnetization in the branches of the cross, a domain wall is found to propagate in an unwanted direction yi…
Structural, vibrational, and electronic properties of TlReO4 studied using a first principles approach
2019
Present work provides extensive DFT study of TlReO4 using pseudopotential approach for understanding the structural and vibrational properties and full-potential linearized augmented plane wave method for electronic band structure and associated optical properties. Calculated bulk modulus value 29.77 GPa using LDA functional is found to be close to experimental value 26 GPa. The order of elastic constant along the principal axis clearly indicates the crucial role of Re and O3 atoms in the structural and mechanical properties of this material. Analysis of Born effective charge (BEC) along with gamma point phonon frequencies through density functional perturbation approach (DFPT) have also sh…
Macroscopic description of the two-dimensional LaAlO$_3$/SrTiO$_3$ interface
2015
We propose a simple analytical model to explain possible appearance of the metallic conductivity in the two-dimensional (2D) LaAlO$_3$/SrTiO$_3$ interface. Our model considers the interface within a macroscopic approach which is usual to semiconductor heterojunctions and is based on drift-diffusion equations. The solution of these equations allows to obtain the positions of band edges as a function of distances from the interface. We show that for the 2D metallic conductivity to appear at the interface, the constituting substances should have the same type (either electronic or hole) of conductivity; in the opposite case the possible transition to metallic phase has a three-dimensional char…
Ab initio calculations of the atomic and electronic structures for ABO3 perovskite (001) surfaces
2004
We present the results of first-principles calculations on two possible terminations of the (001) surfaces of SrTiO3 (STO), BaTiO3 (BTO), and PbTiO3 (PTO) perovskite crystals. Atomic structure and the electronic configurations were calculated for different 2D slabs, both stoichiometric and non-stoichiometric, using hybrid (B3PW) exchange-correlation technique and reoptimized basis sets of atomic (Gaussian) orbitals. Results are compared with previous calculations and available experimental data. The electronic density distribution near the surface and covalency effects are discussed in details for all three perovskites.
Challenges in Truncating the Hierarchy of Time-Dependent Reduced Density Matrices Equations: Open Problems
2012
In this work, we analyze the Born, Bogoliubov, Green, Kirkwood and Yvon (BBGKY) hierarchy of equations for describing the full time-evolution of a many-body fermionic system in terms of its reduced density matrices (at all orders). We provide an exhaustive study of the challenges and open problems linked to the truncation of such hierarchy of equations to make them practically applicable. We restrict our analysis to the coupled evolution of the one- and two-body reduced density matrices, where higher order correlation effects are embodied into the approximation used to close the equations. We prove that within this approach, the number of electrons and total energy are conserved, regardless…
Coarse-graining collective skyrmion dynamics in confined geometries
2023
Magnetic skyrmions are magnetic quasi-particles with enhanced stability and different manipulation mechanisms using external fields and currents making them promising candidates for future applications for instance in neuromorphic computing. Recently, several measurements and simulations have shown that thermally activated skyrmions in confined geometries, as they are necessary for device applications, arrange themselves predominantly based on commensurability effects. In this simulational study, based on the Thiele model, we investigate the enhanced dynamics and degenerate non-equilibrium steady state of a system in which the intrinsic skyrmion-skyrmion and skyrmion-boundary interaction co…
New Approach to Determine the Quality of Graphene
2017
The reduction of graphene oxide is one of the most facile methods to fabricate a large amount of graphene and the reduction rate of graphene oxide is related with the quality of synthesized graphene for its possible application. The reduction rate is usually determined by using various spectroscopy measurements such as Raman spectroscopy, Fourier transform infrared spectroscopy, and X-ray photoelectron spectroscopy. Here we propose that the magnetic data can be used as a means of determining the quality of graphene oxide (GO) and reduced graphene oxide (RGO) by the investigation of close relation between magnetic moment and chemical bonding state. Our experimental findings and previous theo…
Spinorial formulation of the GW-BSE equations and spin properties of excitons in 2D Transition Metal Dichalcogenides
2021
In many paradigmatic materials, like Transition Metal Dichalcogenides, the role played by the spin degrees of freedom is as important as the one played by the electron-electron interaction. Thus an accurate treatment of the two effects and of their interaction is necessary for an accurate and predictive study of the optical and electronic properties of these materials. Despite the GW-BSE approach correctly accounts for electronic correlations the spin-orbit coupling effect is often neglected or treated perturbatively. Recently spinorial formulations of GW-BSE have become available in different flavours in material-science codes. Still an accurate validation and comparison of different appro…
Curvature in graphene nanoribbons generates temporally and spatially focused electric currents
2015
Today graphene nanoribbons and other graphene-based nanostructures can be synthesized with atomic precision. But while investigations have concentrated on straight graphene ribbons of fixed crystal orientation, ribbons with intrinsic curvature have remained mainly unexplored. Here, we investigate electronic transport in intrinsically curved graphene nanoribbons coupled to straight leads, using two computational approaches. Stationary approach shows that while the straight leads govern the conductance gap, the presence of curvature blurs the gap and reduces on-off ratio. An advanced time-dependent approach shows that behind the fa\c{c}ade of calm stationary transport the currents run violent…