107 research outputs found
Anderson localization of polaron states
Using the vanishing of the typical polaron tunneling rate as an indicator of
the breakdown of itinerancy, we study the localization of polaron states in a
generic model for a disordered polaronic material. We find that extremely small
disorder causes an Anderson localization of small polaron states. However, the
ratio between the critical disorder strength needed to localize all states in
the polaron band and the renormalized bandwidth is not necessarily smaller than
for a bare electron.Comment: 4 pages, 3 figure
Polaron Effective Mass, Band Distortion, and Self-Trapping in the Holstein Molecular Crystal Model
We present polaron effective masses and selected polaron band structures of
the Holstein molecular crystal model in 1-D as computed by the Global-Local
variational method over a wide range of parameters. These results are augmented
and supported by leading orders of both weak- and strong-coupling perturbation
theory. The description of the polaron effective mass and polaron band
distortion that emerges from this work is comprehensive, spanning weak,
intermediate, and strong electron-phonon coupling, and non-adiabatic, weakly
adiabatic, and strongly adiabatic regimes. Using the effective mass as the
primary criterion, the self-trapping transition is precisely defined and
located. Using related band-shape criteria at the Brillouin zone edge, the
onset of band narrowing is also precisely defined and located. These two lines
divide the polaron parameter space into three regimes of distinct polaron
structure, essentially constituting a polaron phase diagram. Though the
self-trapping transition is thusly shown to be a broad and smooth phenomenon at
finite parameter values, consistency with notion of self-trapping as a critical
phenomenon in the adiabatic limit is demonstrated. Generalizations to higher
dimensions are considered, and resolutions of apparent conflicts with
well-known expectations of adiabatic theory are suggested.Comment: 28 pages, 15 figure
Quantum Monte Carlo and variational approaches to the Holstein model
Based on the canonical Lang-Firsov transformation of the Hamiltonian we
develop a very efficient quantum Monte Carlo algorithm for the Holstein model
with one electron. Separation of the fermionic degrees of freedom by a
reweighting of the probability distribution leads to a dramatic reduction in
computational effort. A principal component representation of the phonon
degrees of freedom allows to sample completely uncorrelated phonon
configurations. The combination of these elements enables us to perform
efficient simulations for a wide range of temperature, phonon frequency and
electron-phonon coupling on clusters large enough to avoid finite-size effects.
The algorithm is tested in one dimension and the data are compared with
exact-diagonalization results and with existing work. Moreover, the ideas
presented here can also be applied to the many-electron case. In the
one-electron case considered here, the physics of the Holstein model can be
described by a simple variational approach.Comment: 18 pages, 11 Figures, v2: one typo correcte
Polaron features of the one-dimensional Holstein Molecular Crystal Model
The polaron features of the one-dimensional Holstein Molecular Crystal Model
are investigated by improving a variational method introduced recently and
based on a linear superposition of Bloch states that describe large and small
polaron wave functions. The mean number of phonons, the polaron kinetic energy,
the electron-phonon local correlation function, and the ground state spectral
weight are calculated and discussed. A crossover regime between large and small
polaron for any value of the adiabatic parameter is found and a
polaron phase diagram is proposed.Comment: 12 pages, 2 figure
Effects of dimensionality and anisotropy on the Holstein polaron
We apply weak-coupling perturbation theory and strong-coupling perturbation
theory to the Holstein molecular crystal model in order to elucidate the
effects of anisotropy on polaron properties in D dimensions. The ground state
energy is considered as a primary criterion through which to study the effects
of anisotropy on the self-trapping transition, the self-trapping line
associated with this transition, and the adiabatic critical point. The effects
of dimensionality and anisotropy on electron-phonon correlations and polaronic
mass enhancement are studied, with particular attention given to the polaron
radius and the characteristics of quasi-1D and quasi-2D structures.
Perturbative results are confirmed by selected comparisons with variational
calculations and quantum Monte Carlo data
Lattice dynamics effects on small polaron properties
This study details the conditions under which strong-coupling perturbation
theory can be applied to the molecular crystal model, a fundamental theoretical
tool for analysis of the polaron properties. I show that lattice dimensionality
and intermolecular forces play a key role in imposing constraints on the
applicability of the perturbative approach. The polaron effective mass has been
computed in different regimes ranging from the fully antiadiabatic to the fully
adiabatic. The polaron masses become essentially dimension independent for
sufficiently strong intermolecular coupling strengths and converge to much
lower values than those tradition-ally obtained in small-polaron theory. I find
evidence for a self-trapping transition in a moderately adiabatic regime at an
electron-phonon coupling value of .3. Our results point to a substantial
independence of the self-trapping event on dimensionality.Comment: 8 pages, 5 figure
Nonperturbative renormalization group approach to frustrated magnets
This article is devoted to the study of the critical properties of classical
XY and Heisenberg frustrated magnets in three dimensions. We first analyze the
experimental and numerical situations. We show that the unusual behaviors
encountered in these systems, typically nonuniversal scaling, are hardly
compatible with the hypothesis of a second order phase transition. We then
review the various perturbative and early nonperturbative approaches used to
investigate these systems. We argue that none of them provides a completely
satisfactory description of the three-dimensional critical behavior. We then
recall the principles of the nonperturbative approach - the effective average
action method - that we have used to investigate the physics of frustrated
magnets. First, we recall the treatment of the unfrustrated - O(N) - case with
this method. This allows to introduce its technical aspects. Then, we show how
this method unables to clarify most of the problems encountered in the previous
theoretical descriptions of frustrated magnets. Firstly, we get an explanation
of the long-standing mismatch between different perturbative approaches which
consists in a nonperturbative mechanism of annihilation of fixed points between
two and three dimensions. Secondly, we get a coherent picture of the physics of
frustrated magnets in qualitative and (semi-) quantitative agreement with the
numerical and experimental results. The central feature that emerges from our
approach is the existence of scaling behaviors without fixed or pseudo-fixed
point and that relies on a slowing-down of the renormalization group flow in a
whole region in the coupling constants space. This phenomenon allows to explain
the occurence of generic weak first order behaviors and to understand the
absence of universality in the critical behavior of frustrated magnets.Comment: 58 pages, 15 PS figure
Five-year outcomes of chronic total occlusion treatment with a biolimus A9-eluting biodegradable polymer stent versus a sirolimus-eluting permanent polymer stent in the LEADERS all-comers trial
Background: Few data are available on long-term follow-up of drug-eluting stents in the treatment of chronic total occlusion (CTO). The LEADERS CTO sub-study compared the long-term results in CTO and non-CTO lesions of a Biolimus A9™-eluting stent (BES) with a sirolimus-eluting stent (SES). Methods: Among 1,707 patients enrolled in the prospective, multi-center, all-comers LEADERS trial, 81 with CTOs were treated with either a BES (n = 45) or a SES (n = 36). The primary endpoint was the occurrence of major adverse cardiac events (MACE): cardiac death, myocardial infarction (MI) and clinically-indicated target vessel revascularization (TVR). Results: At 5 years, the rate of MACE was numerically higher in the CTO group than in the non-CTO group (29.6% vs. 23.3%; p = 0.173), with a significant increase in the incidence of target lesion revascularization (TLR) (21.0 vs. 12.6; p = 0.033), but no difference in stent thrombosis (ST). Patients with CTO receiving a BES demonstrated a lower incidence of MACE (22.2% vs. 38.9%; p = 0.147) with a significant reduction in TLR compared to patients receiving a SES (11.1% vs. 33.3%, p = 0.0214) with an incidence similar to that observed in the non-CTO group treated with BES (11.6%). Definite ST at 5 years nearly halved in the BES group (4.4% vs. 8.3%, p = 0.478) with no ST in the BES group after the first year (0% vs. 8.3%, p for interaction = 0.009). Conclusions: The use of a BES showed a reduction in MACE, TVR, TLR, and ST over time in the CTO subset with similar outcome as for non-CTO lesions
Correlation between Corrosion Potential and Pitting Potential for AISI 304L Austenitic Stainless Steel in 3.5% NaCl Aqueous Solution
University-industry relationships and open innovation: Towards a research agenda
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