Gaz noble

Résumé

Les gaz nobles, ou gaz rares sont un sous-ensemble d’éléments chimiques du groupe 18 (anciennement « groupe VIIIA », voire « groupe 0 ») du tableau périodique. Ce sont l'hélium He, le néon Ne, l'argon Ar, le krypton Kr, le xénon Xe et le radon Rn, ce dernier étant radioactif, avec une période de pour le , son isotope le plus stable. Ils forment une famille d'éléments chimiques très homogène de gaz monoatomiques incolores et inodores chimiquement très peu réactifs, voire totalement inertes pour les deux plus légers — hormis dans des conditions très particulières. L'oganesson Og, découvert au début du , prolonge le , mais ses propriétés chimiques sont encore trop largement méconnues pour pouvoir le ranger dans une quelconque famille ; les effets relativistes d'un noyau atomique très chargé sur son cortège électronique pourraient en altérer suffisamment les propriétés, de sorte que cet élément, qui serait probablement solide et non gazeux, ne serait plus nécessairement un gaz noble. Le

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The interaction between 3, 4, 9, 10-perylenetetracarboxylic dianhydride (PTCDA) and rare gas or para-hydrogen samples is studied by means of laser-induced fluorescence excitation spectroscopy. The comparison between spectra of PTCDA embedded in a neon matrix and spectra attached to large neon clusters shows that these large organic molecules reside on the surface of the clusters when doped by the pick-up technique. PTCDA molecules can adopt different conformations when attached to argon, neon, and para-hydrogen clusters which implies that the surface of such clusters has a well-defined structure without liquid or fluxional properties. Moreover, a precise analysis of the doping process of these clusters reveals that the mobility of large molecules on the cluster surface is quenched, preventing agglomeration and complex formation. (C) 2012 American Institute of Physics. [http://dx.doi.org/10.1063/1.4759443]

American Institute of Physics2012

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Ferritic/martensitic steels are candidate materials for fusion reactor structural components, liquid metal containers of spallation neutron sources, and accelerator driven systems, with good radiation resistance and thermo-mechanical properties. However, embrittlement resulting from the combined effects of radiation induced displacement damage (measured in dpa = displacement per atom) and transmutation products, especially helium gas, is one of the key issues. Four different steels were selected for mechanical and microstructural studies to understand the mechanisms of embrittlement induced by the combined effects of displacement damage and helium after irradiation in SINQ, the Swiss spallation source. The irradiations conditions were in the range: 10.7 ¿ 20.4 dpa with 850-1750 appm He at 160-300 °C. The evolution of the mechanical properties after irradiation was investigated by tensile and hardness tests. Radiation-induced defect clusters and helium bubbles were quantified by transmission electron microscopy (TEM). Emphasis was put on the deformation mechanisms under the different observed fracture mode, (ductile, quasi-cleavage and intergranular), whose occurrence depends on the irradiation conditions (dpa, He content and irradiation temperature). The tensile stress-strain curves and the scanning electron microscopy images of fracture surfaces showed distinct fracture mechanisms under different irradiation and test conditions. The tensile tests showed a yielding stress increase and loss of ductility of irradiated specimens. Hardness was measured on the specimens before tensile testing. The hardness results demonstrated an increasing trend with irradiation dose and helium content. TEM observations were done for all irradiated fractured specimens. Small defect clusters were observed in the 12.3 dpa specimen, but large defect clusters with loop-shape were very few. In the specimens of 17.2, 17.7 and 20.4 dpa, many large dislocation loops were detected besides small clusters. In addition, helium bubbles were observed in all specimens. The average size of defect clusters increased from 4.2 nm to 11.8 nm with dose increasing from 12.3 dpa to 20.4 dpa, whereas the number density did not change significantly. Meanwhile, the average size of visible helium bubbles increased from 1.03 nm to 1.93 nm. The microstructures in deformed area of irradiated specimens were observed and defect free channels with {110} and {112} slip planes were found in some specimens, indicating plastic flow localization. The average width of the channels is about 100 nm. Regarding the brittle samples, the TEM-lamella were extracted directly below intergranular fracture surfaces or cleavage surfaces by focused ion beam. Strikingly, deformation twinning was observed as the main feature in three irradiated specimens at high dose. Only twins with {112} planes were observed in all of these samples. The average thickness of twins is about 34 nm. Twins started from a fracture surface became gradually thinner with distance away from the fracture surface and stopped in the matrix finally. Features such as twin-precipitates interaction, twin-grain boundary and/or lath boundary interaction were observed. Twinning bands were seen to be arrested by grain boundaries or large precipitates, but could penetrate martensitic lath boundaries. Unlike the case of defect free channels, inside twins small defect-clusters, dislocation loops and dense small helium bubbles were observed.

EPFL2015

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Results of a theoretical study on the properties of Ir4 clusters in the gas–phase and on oxide surfaces are presented. The work is based on density functional theory (DFT) within the generalized gradient approximation (GGA) and ultrasoft pseudopotentials. Properties of a small particle such as Ir4 cluster are entirely determined by its geometry. The already known result that the most stable form of Ir4 in the gas–phase is the square structure which is significantly more stable than the butterfly and tetrahedron is confirmed. This result is in contradiction with experiments which indicate that the oxide supported Ir4 adopts a tetrahedral configuration. It is shown in this thesis that the chemical environment has a strong influence on the relative stability of Ir4 clusters. On MgO(100) surface, the square isomer remains the most stable Ir4 structure, well separated in energy from the other two. Moreover, the tetrahedron is heavily distorted by the interaction with the surface oxygen. Presence of point defects (neutral and charged O vacancies) affects the energy ordering making tetrahedron and square very close in energy, but the structural distortion of the tetrahedron is even bigger and the predicted data do not correspond to experiments. On TiO2(110) the tetrahedron and square structures become degenerate and the butterfly becomes the least stable isomer. Moreover, structural distortions are very small, in agreement with experimental data. It is shown that the TiO2 surface influences the relative stability of the three isomers through a particularly strong electrostatic field. Interactions of Ir4 with H, C and O atoms as well as with CO molecules have been studied. Adsorption of a single C atom strongly influences the relative stability of the three isomers. Upon C adsorption, the butterfly becomes the most stable gas–phase isomer while on both surfaces the tetrahedron is the most probable structure. Adsorption of a single H or O atom does not produce the same effect. The interaction with CO molecules is also important given the experimental procedure used for producing supported Ir4 clusters. It is shown that on MgO(100), CO dissociation is as probable as the competing process CO desorption justifying the presence of carbon adatoms on Ir4 clusters which brings theoretical predictions in better agreement with experimental data.

EPFL2009

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EPFL2009