Activated sampling in complex materials at finite temperature: the properly-obeying-probability activation-relaxation technique

While the dynamics of many complex systems is dominated by activated events, there are very few simulation methods that take advantage of this fact. Most of these procedures are restricted to relatively simple systems or, as with the activation-relaxation technique (ART), sample the conformation space efficiently at the cost of a correct thermodynamical description. We present here an extension of ART, the properly-obeying-probability ART (POP-ART), that obeys detailed balance and samples correctly the thermodynamic ensemble. Testing POP-ART on two model systems, a vacancy and an interstitial in crystalline silicon, we show that this method recovers the proper thermodynamical weights associated with the various accessible states and is significantly faster than MD in the diffusion of a vacancy below 700 K.Comment: 10 pages, 3 figure

Interaction between static holes in a quantum dimer model on the kagome lattice

A quantum dimer model (QDM) on the kagome lattice with an extensive ground-state entropy was recently introduced [Phys. Rev. B 67, 214413 (2003)]. The ground-state energy of this QDM in presence of one and two static holes is investigated by means of exact diagonalizations on lattices containing up to 144 kagome sites. The interaction energy between the holes (at distances up to 7 lattice spacings) is evaluated and the results show no indication of confinement at large hole separations.Comment: 6 pages, 3 figures. IOP style files included. To appear in J. Phys.: Condens. Matter, Proceedings of the HFM2003 conference, Grenobl

Tournée de l'association Forêt Méditerranéenne dans le Gargano en Italie du Sud, du 24 au 27 Mai 2001

International audienc

First- and second-order transitions of the escape rate in ferrimagnetic or antiferromagnetic particles

Quantum-classical escape-rate transition has been studied for two general forms of magnetic anisotropy in ferrimagnetic or antiferromagnetic particles. It is found that the range of the first-order transition is greatly reduced as the system becomes ferrimagnetic and there is no first-order transition in almost compensated antiferromagnetic particles. These features can be tested experimentally in nanomagnets like molecular magnets.Comment: 11 pages, 3 figures, to appear in Europhys. Let

Acoustic emission monitoring of wet H2S cracking of linepipe steels: Application to hydrogen-induced cracking and stress-oriented hydrogen-induced cracking

cited By 9International audienceAcoustic emission (AE) was used for monitoring steel cracking during exposure to wet hydrogen sulfide (H2S) environments. A method for filtering AE data related to hydrogen-induced cracking (HIC) was presented and applied for several case studies. In a series of tests on unstressed sweet service steels, evolution of AE indicated three successive HIC phases. An initial incubation period corresponded to hydrogen entry in the steel, during which no cracking occurred. Then two cracking phases were detected. The first was associated with decohesion of weak steel interphases. The second was identified as crack propagation under high internal hydrogen pressure. Crack propagation decreased and eventually ceased over time. Analysis of AE data was then used to evaluate the extent of HIC after sour exposure. Correlation was found when appropriate data filtering was applied. AE analysis was also applied to sour service steels under an applied load. The first steel exhibited HIC AE signals. Its fracture surface was typical of a stress-oriented hydrogen-induced cracking (SOHIC) mode of failure, in good agreement with AE results. For the second steel, which also failed during the test, no AE related to HIC was detected. Fracture surface was typical of sulfide stress cracking (SSC), also in good agreement with AE findings. © 2011, NACE International

Contribution of acoustic emission to the understanding of sulfide stress cracking of low alloy steels

cited By 17International audienceThe acoustic emission technique was applied to standard tests devoted to evaluate sulfide stress cracking susceptibility of steels for oil and gas industry. The mapping of the density of AE signals vs. their location on the specimen gauge length as a function of time allowed early detection of cracking, and gave meaningful information on incubation times and propagation rates. Sulfide stress cracking initiation was correlated with the presence of critical surface defects. A mechanism involving plastic strain and/or metal dissolution was proposed to account for crack propagation. © 2011 Elsevier Ltd

The use of segmented regression in analysing interrupted time series studies : an example in pre-hospital ambulance care

Peer reviewedPublisher PD

Comparison of the effects of different anesthetics on serum haemolysis and glycogenolysis in rats

The anesthetics can differently affect the structure and biological function of tissues and systems. The objective of this study was to compare the effects of three injectable anesthetics generally used in experiments with animals on the degree of haemolysis and glycogenolysis after deep anesthesia. 20 Wistar male rats (330-440g) were used. The animals were divided into three groups: Cloral Hydrate (CH), Ketamine + Xylazine (KX), Zoletil 50® (zolazepam and tiletamina) + Xylazine (ZTX). After deep anesthesia the total blood was collected. Immediately the liver, the white and red gastrocnemius muscles were also withdrawn. The degree of serum haemolysis was quantified by the hemoglobin concentration (g/dL) and the hepatic and muscular glycogen concentration through spectrophotometer analyses. The CH and KX groups presented serum haemolysis (0.49 ± 0.06 g/dL and 0.18 ± 0.06 g/dL, respectively). ZTX group presented no detectable values. The average value of the hepatic and muscular glycogen concentrations exhibited no significant difference between CH and ZTX groups. The data were similar to other studies in the literature. However, the KX induced accentuated glycogenolysis in all tissues. Our data suggest that the anesthetic ZTX seems to be the most appropriate for studies that need simultaneously to quantify the concentration of glycogen and blood markers without interferences. It neither causes glycogenolysis nor haemolysis. ZTX possesses accessible cost, is easily found at veterinary markets, quickly induces deep anesthesia and presents low mortality rate