358 research outputs found
The Meissner effect in a strongly underdoped cuprate above its critical temperature
The Meissner effect and the associated perfect "bulk" diamagnetism together
with zero resistance and gap opening are characteristic features of the
superconducting state. In the pseudogap state of cuprates unusual diamagnetic
signals as well as anomalous proximity effects have been detected but a
Meissner effect has never been observed. Here we have probed the local
diamagnetic response in the normal state of an underdoped La1.94Sr0.06CuO4
layer (up to 46 nm thick, critical temperature Tc' < 5 K) which was brought
into close contact with two nearly optimally doped La1.84Sr0.16CuO4 layers (Tc
\approx 32 K). We show that the entire 'barrier' layer of thickness much larger
than the typical c axis coherence lengths of cuprates exhibits a Meissner
effect at temperatures well above Tc' but below Tc. The temperature dependence
of the effective penetration depth and superfluid density in different layers
indicates that superfluidity with long-range phase coherence is induced in the
underdoped layer by the proximity to optimally doped layers; however, this
induced order is very sensitive to thermal excitation.Comment: 7 pages, 7 figures + Erratu
Modeling and simulations of beam stabilization in edge-emitting broad area semiconductor devices
A 2+1 dimensional PDE traveling wave model describing spatial-lateral
dynamics of edge-emitting broad area semiconductor devices is considered. A
numerical scheme based on a split-step Fourier method is presented and
implemented on a parallel compute cluster. Simulations of the model equations
are used for optimizing of existing devices with respect to the emitted beam
quality, as well as for creating and testing of novel device design concept
Quantum Diffusion in Separable d-Dimensional Quasiperiodic Tilings
We study the electronic transport in quasiperiodic separable tight-binding
models in one, two, and three dimensions. First, we investigate a
one-dimensional quasiperiodic chain, in which the atoms are coupled by weak and
strong bonds aligned according to the Fibonacci chain. The associated
d-dimensional quasiperiodic tilings are constructed from the product of d such
chains, which yields either the square/cubic Fibonacci tiling or the labyrinth
tiling. We study the scaling behavior of the mean square displacement and the
return probability of wave packets with respect to time. We also discuss
results of renormalization group approaches and lower bounds for the scaling
exponent of the width of the wave packet.Comment: 6 pages, 4 figures, conference proceedings Aperiodic 2012 (Cairns
Intermittent dislocation flow in viscoplastic deformation
The viscoplastic deformation (creep) of crystalline materials under constant
stress involves the motion of a large number of interacting dislocations.
Analytical methods and sophisticated `dislocation-dynamics' simulations have
proved very effective in the study of dislocation patterning, and have led to
macroscopic constitutive laws of plastic deformation. Yet, a statistical
analysis of the dynamics of an assembly of interacting dislocations has not
hitherto been performed. Here we report acoustic emission measurements on
stressed ice single crystals, the results of which indicate that dislocations
move in a scale-free intermittent fashion. This result is confirmed by
numerical simulations of a model of interacting dislocations that successfully
reproduces the main features of the experiment. We find that dislocations
generate a slowly evolving configuration landscape which coexists with rapid
collective rearrangements. These rearrangements involve a comparatively small
fraction of the dislocations and lead to an intermittent behavior of the net
plastic response. This basic dynamical picture appears to be a generic feature
in the deformation of many other materials. Moreover, it should provide a
framework for discussing fundamental aspects of plasticity, that goes beyond
standard mean-field approaches that see plastic deformation as a smooth laminar
flow
Oxygen Isotope Effect Resulting from Polaron-induced Superconductivity in Cuprates
The planar oxygen isotope effect coefficient measured as a function of hole
doping in the Pr- and La-doped YBa2Cu3O7 (YBCO) and the Ni-doped
La1.85Sr0.15CuO4 (LSCO) superconductors quantitatively and qualitatively
follows the form originally proposed by Kresin and Wolf, which was derived for
polarons perpendicular to the superconducting planes. Interestingly, the
inverse oxygen isotope effect coefficient at the pseudogap temperature also
follows the same formula. These findings allow the conclusion that the
superconductivity in YBCO and LSCO results from polarons or rather bipolarons
in the CuO2 plane. The original formula, proposed for the perpendicular
direction only, is obviously more generally valid and accounts for the
superconductivity in the CuO2 planes.Comment: Dedicated to Alex M\"uller on the occasion of his 90th birthda
Imaging the Two Gaps of the High-TC Superconductor Pb-Bi2Sr2CuO6+x
The nature of the pseudogap state, observed above the superconducting
transition temperature TC in many high temperature superconductors, is the
center of much debate. Recently, this discussion has focused on the number of
energy gaps in these materials. Some experiments indicate a single energy gap,
implying that the pseudogap is a precursor state. Others indicate two,
suggesting that it is a competing or coexisting phase. Here we report on
temperature dependent scanning tunneling spectroscopy of Pb-Bi2Sr2CuO6+x. We
have found a new, narrow, homogeneous gap that vanishes near TC, superimposed
on the typically observed, inhomogeneous, broad gap, which is only weakly
temperature dependent. These results not only support the two gap picture, but
also explain previously troubling differences between scanning tunneling
microscopy and other experimental measurements.Comment: 6 page
In silico-designed lignin peroxidase from Phanerochaete chrysosporium shows enhanced acid stability for depolymerization of lignin
Background: The lignin peroxidase isozyme H8 from the white-rot fungus Phanerochaete chrysosporium (LiPH8) demonstrates a high redox potential and can efficiently catalyze the oxidation of veratryl alcohol, as well as the degradation of recalcitrant lignin. However, native LiPH8 is unstable under acidic pH conditions. This characteristic is a barrier to lignin depolymerization, as repolymerization of phenolic products occurs simultaneously at neutral pH. Because repolymerization of phenolics is repressed at acidic pH, a highly acid-stable LiPH8 could accelerate the selective depolymerization of recalcitrant lignin.
Results: The engineered LiPH8 was in silico designed through the structural superimposition of surface-active site-harboring LiPH8 from Phanerochaete chrysosporium and acid-stable manganese peroxidase isozyme 6 (MnP6) from Ceriporiopsis subvermispora. Effective salt bridges were probed by molecular dynamics simulation and changes to Gibbs free energy following mutagenesis were predicted, suggesting promising variants with higher stability under extremely acidic conditions. The rationally designed variant, A55R/N156E-H239E, demonstrated a 12.5-fold increased half-life under extremely acidic conditions, 9.9-fold increased catalytic efficiency toward veratryl alcohol, and a 7.8-fold enhanced lignin model dimer conversion efficiency compared to those of native LiPH8. Furthermore, the two constructed salt bridges in the variant A55R/N156E-H239E were experimentally confirmed to be identical to the intentionally designed LiPH8 variant using X-ray crystallography (PDB ID: 6A6Q).
Conclusion: Introduction of strong ionic salt bridges based on computational design resulted in a LiPH8 variant with markedly improved stability, as well as higher activity under acidic pH conditions. Thus, LiPH8, showing high acid stability, will be a crucial player in biomass valorization using selective depolymerization of lignin
Common and Distant Structural Characteristics of Feruloyl Esterase Families from Aspergillus oryzae
Background: Feruloyl esterases (FAEs) are important biomass degrading accessory enzymes due to their capability of cleaving the ester links between hemicellulose and pectin to aromatic compounds of lignin, thus enhancing the accessibility of plant tissues to cellulolytic and hemicellulolytic enzymes. FAEs have gained increased attention in the area of biocatalytic transformations for the synthesis of value added compounds with medicinal and nutritional applications. Following the increasing attention on these enzymes, a novel descriptor based classification system has been proposed for FAEs resulting into 12 distinct families and pharmacophore models for three FAE sub-families have been developed. Methodology/Principal Findings: The feruloylome of Aspergillus oryzae contains 13 predicted FAEs belonging to six sub-families based on our recently developed descriptor-based classification system. The three-dimensional structures of the 13 FAEs were modeled for structural analysis of the feruloylome. The three genes coding for three enzymes, viz., A.O.2, A.O.8 and A.O.10 from the feruloylome of A. oryzae, representing sub-families with unknown functional features, were heterologously expressed in Pichia pastoris, characterized for substrate specificity and structural characterization through CD spectroscopy. Common feature-based pharamacophore models were developed according to substrate specificity characteristics of the three enzymes. The active site residues were identified for the three expressed FAEs by determining the titration curves of amino acid residues as a function of the pH by applying molecular simulations. Conclusions/Significance: Our findings on the structure-function relationships and substrate specificity of the FAEs of A. oryzae will be instrumental for further understanding of the FAE families in the novel classification system. The developed pharmacophore models could be applied for virtual screening of compound databases for short listing the putative substrates prior to docking studies or for post-processing docking results to remove false positives. Our study exemplifies how computational predictions can complement to the information obtained through experimental methods. © 2012 Udatha et al.published_or_final_versio
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