1,230 research outputs found
Transport studies of LPA electron beam towards the FEL amplification at COXINEL
Laser Plasma Acceleration (LPA) [1] is an emerging concept enabling to
generate electron beams with high energy, high peak current and small
transverse emittance within a very short distance. The use of LPA can be
applied to the Free Electron Laser (FEL) [2] case in order to investigate
whether it is suitable for the light amplification in the undulator. However,
capturing and guiding of such beams to the undulator is very challenging,
because of the large divergence and high energy spread of the electron beams at
the plasma exit, leading to large chromatic emittances. A specific beam
manipulation scheme was recently proposed for the COXINEL (Coherent X-ray
source inferred from electrons accelerated by laser) setup, which makes an
advantage from the intrinsically large chromatic emittance of such beams [3].
The electron beam transport is studied using two simulation codes: a SOLEIL
in-house one and ASTRA [4]. The influence of the collective effects on the
electron beam performance is also examined
Structure and Magnetic Properties of the Radical Cation Salt of a TTF-based NiII Complex
Chemical oxidation of a TTF-based NiII complex with I2 produces the corresponding radical cation salt 1, [Ni2Cl2(L)2](I3)2(I5)2(I2)(H2O)2(C4H8O)3, (L=4,5-bis(2-pyridylmethylsulfanyl)-4',5'-ethylenedithiotetrathiafulvalene). The results of magnetic susceptibility measurements show the occurrence of intramolecular magnetic exchange interactions in 1. The lack of close S···S contacts, confirmed by crystal structure analysis, results in an insulating behavio
Dithiinmaleimide Functionalized ET Derivatives: Syntheses, Characterization and X-ray Structure
Dithiinmaleimide (ethylenedithio)tetrathiafulvalene (1) and N-phenyldithiinmaleimide (ethylenedithio)tetrathiafulvalene (2) have been synthesized from bis(tetraethylammonium)bis(ethylenedithiotetrathiafulvalenyldithiolato)-zincate (3) in high yields. Their electrochemical properties were investigated by cyclic voltammetry (CV) measurements which show two reversible redox potentials of the tetrathiafulvalene (TTF) moiety and an irreversible reduction potential of the maleimide ring. The X-ray structure of 1 shows close S···S contacts in the range of the van der Waals radii (3.6 Å) and hydrogen bonds between the maleimide unite
Bond energy/eond order relationships for N-O linkages and a quantitative measure of ionicity: the rôle of nitro groups in hydrogen bonding
The nitro group is active in metabolic systems and can be found as an integral part of a number of useful curative drugs and many toxic substances. The basis for much of this activity is not fully understood. It is not necessarily caused directly by through-bond electronic effects but may also be due to direct H-bonding to nitro or to indirect interference by the nitro group with existing H-bonding. An unusual effect of a nitro substituent on kinetic results from urethane addition/elimination reactions (Scheme 1) has been ascribed to some form of self-association, which was neither specified nor quantified. To investigate self-association phenomena caused by a nitro group, a bond energy/bond order formula for N–O bonds has been developed and then used to interpret relative amounts of covalent and ionic contributions to total N–O bond energy. Calculated bond energies were then used to obtain enthalpies of formation for H-bonds to nitro groups in crystals and in solution. Similar results from solution data reveal that direct H-bonding to nitro is much weaker than in crystals, unless intramolecular H-bonding can occur. The results revealed that the 'self-association' effects observed for nitro substituents in urethanes (Scheme 1) were not caused by nitro participating directly in intermolecular bonding to NH of another urethane but by an indirect intramolecular action of the nitro group on pre-existing normal NH–O amide/amide type H-bonding
Stability and Electronic Properties of TiO2 Nanostructures With and Without B and N Doping
We address one of the main challenges to TiO2-photocatalysis, namely band gap
narrowing, by combining nanostructural changes with doping. With this aim we
compare TiO2's electronic properties for small 0D clusters, 1D nanorods and
nanotubes, 2D layers, and 3D surface and bulk phases using different
approximations within density functional theory and GW calculations. In
particular, we propose very small (R < 0.5 nm) but surprisingly stable
nanotubes with promising properties. The nanotubes are initially formed from
TiO2 layers with the PtO2 structure, with the smallest (2,2) nanotube relaxing
to a rutile nanorod structure. We find that quantum confinement effects - as
expected - generally lead to a widening of the energy gap. However,
substitutional doping with boron or nitrogen is found to give rise to
(meta-)stable structures and the introduction of dopant and mid-gap states
which effectively reduce the band gap. Boron is seen to always give rise to
n-type doping while depending on the local bonding geometry, nitrogen may give
rise to n-type or p-type doping. For under coordinated TiO2 surface structures
found in clusters, nanorods, nanotubes, layers and surfaces nitrogen gives rise
to acceptor states while for larger clusters and bulk structures donor states
are introduced
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Open-communication project : a case study of its development and implementation as a strategy for self-renewal of an urban junior high school.
EducationDoctor of Education (Ed.D.
Presentation of the Smith-Purcell Experiment at SOLEIL
TUPC37 - Work supported by seed funding from Université Paris-Sud, program "Attractivité" and by the ANR under contract ANR-12-JS05-0003-01International audienceThe potential of Coherent Smith-Purcell radiation as a longitudinal bunch profile monitor has already been demonstrated and has recently been extended to the sub-picosecond range. As a critical step toward the construction of a single shot bunch profile monitor using Coherent Smith-Purcell radiation it is important to measure very accurately the distribution of such radiation. Optimum background suppression techniques need to be found and relatively cheap detectors suitable for the far infra-red need to be qualified. To performthese tasks a test stand has been installed at the end of the linac of the synchrotron SOLEIL. This test stand and the first results from its commissioning will be presented here
Resonant Lifetime of Core-Excited Organic Adsorbates from First Principles
We investigate by first-principles simulations the resonant electron-transfer
lifetime from the excited state of an organic adsorbate to a semiconductor
surface, namely isonicotinic acid on rutile TiO(110). The
molecule-substrate interaction is described using density functional theory,
while the effect of a truly semi-infinite substrate is taken into account by
Green's function techniques. Excitonic effects due to the presence of
core-excited atoms in the molecule are shown to be instrumental to understand
the electron-transfer times measured using the so-called core-hole-clock
technique. In particular, for the isonicotinic acid on TiO(110), we find
that the charge injection from the LUMO is quenched since this state lies
within the substrate band gap. We compute the resonant charge-transfer times
from LUMO+1 and LUMO+2, and systematically investigate the dependence of the
elastic lifetimes of these states on the alignment among adsorbate and
substrate states.Comment: 24 pages, 6 figures, to appear in Journal of Physical Chemistry
Contribution to the understanding of tribological properties of graphite intercalation compounds with metal chloride
Intrinsic tribological properties of lamellar compounds are usually attributed to the presence of van der Waals gaps in their structure through which interlayer interactions are weak. The controlled variation of the distances and interactions between graphene layers by intercalation of electrophilic species in graphite is used in order to explore more deeply the friction reduction properties of low-dimensional compounds. Three graphite intercalation compounds with antimony pentachloride, iron trichloride and aluminium trichloride are studied. Their tribological properties are correlated to their structural parameters, and the interlayer interactions are deduced from ab initio bands structure calculations
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