1,792 research outputs found
Entropic Origin of Pseudogap Physics and a Mott-Slater Transition in Cuprates
We propose a new approach to understand the origin of the pseudogap in the
cuprates, in terms of bosonic entropy. The near-simultaneous softening of a
large number of different -bosons yields an extended range of short-range
order, wherein the growth of magnetic correlations with decreasing temperature
is anomalously slow. These entropic effects cause the spectral weight
associated with the Van Hove singularity (VHS) to shift rapidly and nearly
linearly toward half filling at higher , consistent with a picture of the
VHS driving the pseudogap transition at a temperature . As a
byproduct, we develop an order-parameter classification scheme that predicts
supertransitions between families of order parameters. As one example, we find
that by tuning the hopping parameters, it is possible to drive the cuprates
across a {\it transition between Mott and Slater physics}, where a
spin-frustrated state emerges at the crossover.Comment: 24 pgs, 15 figs + Supp. Material [6pgs, 3 figs]. Major revision of
arXiv:1505.0477
Current induced domain wall dynamics in the presence of spin orbit torques
Current induced domain wall (DW) motion in perpendicularly magnetized
nanostripes in the presence of spin orbit torques is studied. We show using
micromagnetic simulations that the direction of the current induced DW motion
and the associated DW velocity depend on the relative values of the field like
torque (FLT) and the Slonczewski like torques (SLT). The results are well
explained by a collective coordinate model which is used to draw a phase
diagram of the DW dynamics as a function of the FLT and the SLT. We show that a
large increase in the DW velocity can be reached by a proper tuning of both
torques.Comment: 9 pages, 3 figure
Characterization of Thin Film Materials using SCAN meta-GGA, an Accurate Nonempirical Density Functional
We discuss self-consistently obtained ground-state electronic properties of
monolayers of graphene and a number of beyond graphene compounds, including
films of transition-metal dichalcogenides (TMDs), using the recently proposed
strongly constrained and appropriately normed (SCAN) meta-generalized gradient
approximation (meta-GGA) to the density functional theory. The SCAN meta-GGA
results are compared with those based on the local density approximation (LDA)
as well as the generalized gradient approximation (GGA). As expected, the GGA
yields expanded lattices and softened bonds in relation to the LDA, but the
SCAN meta-GGA systematically improves the agreement with experiment. Our study
suggests the efficacy of the SCAN functional for accurate modeling of
electronic structures of layered materials in high-throughput calculations more
generally
Ab-initio Molecular Dynamics study of electronic and optical properties of silicon quantum wires: Orientational Effects
We analyze the influence of spatial orientation on the optical response of
hydrogenated silicon quantum wires. The results are relevant for the
interpretation of the optical properties of light emitting porous silicon. We
study (111)-oriented wires and compare the present results with those
previously obtained within the same theoretical framework for (001)-oriented
wires [F. Buda {\it et al.}, {\it Phys. Rev. Lett.} {\bf 69}, 1272, (1992)]. In
analogy with the (001)-oriented wires and at variance with crystalline bulk
silicon, we find that the (111)-oriented wires exhibit a direct gap at whose value is largely enhanced with respect to that found in bulk
silicon because of quantum confinement effects. The imaginary part of the
dielectric function, for the external field polarized in the direction of the
axis of the wires, shows features that, while being qualitatively similar to
those observed for the (001) wires, are not present in the bulk. The main
conclusion which emerges from the present study is that, if wires a few
nanometers large are present in the porous material, they are
optically active independently of their specific orientation.Comment: 14 pages (plus 6 figures), Revte
Assessing and enhancing EN 16883:2017
This paper describes the work undertaken within the international project IEA SHC Task 59 Renovating Historic Buildings Towards Zero Energy to produce a handbook for the planning of energy retrofits in historic buildings. The handbook is an attempt to increase use and usability of the European standard EN 16883:2017 - Conservation of cultural heritage -Guidelines for improving the energy performance of historic buildings. The standard provides a decision roadmap for how energy efficiency measures can be identified that both respect the heritage values of the building and improves the energy performance. It also provides general information about energy efficiency in historic buildings. There has been a lot of interest in this standard from researchers in the field of energy efficiency in historic buildings, but it has not been widely used in practice. The first part of the paper summarises an assessment of the use, or lack thereof, of the standard. The assessment is based on nine European case studies that identify how the European standard can be complemented with additional resources, examples and guidance. In the second part the work with a handbook complementing the standard is outlined, and recommendations to future revisions of the standard are suggested
Analytical expression for the quantum dot contribution to the quasistatic capacitance for conduction band characterization
This paper demonstrates an analytical expression for the quasistatic capacitance of a quantum dot layer embedded in a junction, where the reverse bias is used to discharge the initially occupied energy levels. This analysis can be used to determine the position and the Gaussian homogeneous broadening of the energy levels in the conduction band, and is applied for an InGaAs/GaAs quantum dot structure grown by metal organic chemical vapor deposition. It is shown that the Gaussian broadening of the conduction band levels is significantly larger than the broadening of the interband photoluminescence (PL) transitions involving both conduction and hole states. The analysis also reveals a contribution from the wetting layer both in PL and modeled C-V profiles which is much stronger than in typical molecular beam epitaxy grown dots. The presence of a built-in local field oriented from the apex of the dot toward its base, contrary to the direction expected for a strained dot with uniform composition (negative dipole), is also derived from fitting of the C-V experimental data
Spontaneous formation and stability of small GaP fullerenes
We report the spontaneous formation of a GaP fullerene cage in ab-initio
Molecular Dynamics simulations starting from a bulk fragment. A systematic
study of the geometric and electronic properties of neutral and ionized GaP
clusters suggests the stability of hetero-fullerenes formed by a compound with
zincblend bulk structure. We find that GaP fullerenes up to 28 atoms have high
symmetry, closed electronic shells, large HOMO-LUMO energy gaps and do not
dissociate when ionized. We compare our results for GaP with those obtained by
other groups for the corresponding BN clusters.Comment: To appear on PRL, 4 pages, 1 figure, Late
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