566 research outputs found
Ca impurity in small mixed He-He clusters
The structure of small mixed helium clusters doped with one calcium atom has
been determined within the diffusion Monte Carlo framework. The results show
that the calcium atom sits at the He-He interface. This is in agreement
with previous studies, both experimental and theoretical, performed for large
clusters. A comparison between the results obtained for the largest cluster we
have considered for each isotope shows a clear tendency of the Ca atom to
reside in a deep dimple at the surface of the cluster for He clusters, and
to become fully solvated for He clusters. We have calculated the absorption
spectrum of Ca around the transition and have found that
it is blue-shifted from that of the free-atom transition by an amount that
depends on the size and composition of the cluster.Comment: 24 pages, 11 figures. Accepted on Journal of Chemical Physic
Microscopic study of the He2-SF6 trimers
The He2-SF6 trimers, in their different He isotopic combinations, are studied
both in the framework of the correlated Jastrow approach and of the Correlated
Hyperspherical Harmonics expansion method. The energetics and structure of the
He-SF6 dimers are analyzed, and the existence of a characteristic rotational
band in the excitation spectrum is discussed, as well as the isotopic
differences. The binding energies and the spatial properties of the trimers, in
their ground and lowest lying excited states, obtained by the Jastrow ansatz
are in excellent agreement with the results of the converged CHH expansion. The
introduction of the He-He correlation makes all trimers bound by largely
suppressing the short range He-He repulsion.
The structural properties of the trimers are qualitatively explained in terms
of the shape of the interactions, Pauli principle and masses of the
constituents.Comment: 17 pages, 5 figures. Submitted to PR
Equation of state of low--density neutron matter and the pairing gap
We report results of the equation of state of neutron matter in the
low--density regime, where the Fermi wave vector ranges from . Neutron matter in this regime is superfluid because of
the strong and attractive interaction in the channel. The properties of
this superfluid matter are calculated starting from a realistic Hamiltonian
that contains modern two-- and three--body interactions. The ground state
energy and the superfluid energy gap are calculated using the Auxiliary
Field Diffusion Monte Carlo method. We study the structure of the ground state
by looking at pair distribution functions as well as the Cooper-pair wave
function used in the calculations.Comment: 12 pages, 7 figure
Ground state properties of a dilute homogeneous Bose gas of hard disks in two dimensions
The energy and structure of a dilute hard-disks Bose gas are studied in the
framework of a variational many-body approach based on a Jastrow correlated
ground state wave function. The asymptotic behaviors of the radial distribution
function and the one-body density matrix are analyzed after solving the Euler
equation obtained by a free minimization of the hypernetted chain energy
functional. Our results show important deviations from those of the available
low density expansions, already at gas parameter values . The
condensate fraction in 2D is also computed and found generally lower than the
3D one at the same .Comment: Submitted to PRA. 7 pages and 8 figure
Solidification of small para-H2 clusters at zero temperature
We have determined the ground-state energies of para-H clusters at zero
temperature using the diffusion Monte Carlo method. The liquid or solid
character of each cluster is investigated by restricting the phase through the
use of proper importance sampling. Our results show inhomogeneous
crystallization of clusters, with alternating behavior between liquid and solid
phases up to N=55. From there on, all clusters are solid. The ground-state
energies in the range N=13--75 are established and the stable phase of each
cluster is determined. In spite of the small differences observed between the
energy of liquid and solid clusters, the corresponding density profiles are
significantly different, feature that can help to solve ambiguities in the
determination of the specific phase of H clusters.Comment: 17 pages, accepted for publication in J. Phys. Chem.
ECU-oriented models for NOx prediction. Part 2: adaptive estimation by using an NOx sensor
The implantation of nitrogen oxide sensors in diesel engines is necessary in order to track emissions at the engine exhaust line for diagnosis and control of the after-treatment devices. However, the use of models is still necessary since the sensor outputs are delayed and filtered. The present paper deals with the problem of the nitrogen oxide estimation in two parts; Part 1 deals with a control-oriented model for the nitrogen oxide estimation, while Part 2 presents data fusion of the model and the sensor to improve the estimation, which is presented in the following. The use of models for the nitrogen oxide estimation is an alternative but the drift and the ageing are still issues. In order to overcome this problem, the fusion of different signals can be carried out in a smart way by means of a Kalman filter. There exist different ways of presenting this fusion, from directly tracking the bias to updating the model parameters. For this, different algorithms are proposed in this paper with the aim of correcting the model output. Furthermore, the estimation of the actual nitrogen oxide concentration, by preventing sensor delay and filtering, is also integrated in the algorithm, which is a suitable strategy for combining nitrogen oxide sensors and models on an onboard basis.Guardiola, C.; Climent, H.; Pla Moreno, B.; Blanco-Rodriguez, D. (2015). ECU-oriented models for NOx prediction. Part 2: adaptive estimation by using an NOx sensor. Proceedings of the Institution of Mechanical Engineers, Part D: Journal of Automobile Engineering. 229(10):1345-1360. doi:10.1177/0954407014561278S134513602291
Silicon-based three-dimensional microstructures for radiation dosimetry in hadrontherapy
In this work, we propose a solid-state-detector for use in radiation microdosimetry. This device improves the performance of existing dosimeters using customized 3D-cylindrical microstructures etched inside silicon. The microdosimeter consists of an array of micro-sensors that have 3D-cylindrical electrodes of 15 μm diameter and a depth of 5 μm within a silicon membrane, resulting in a well-defined micrometric radiation sensitive volume. These microdetectors have been characterized using an 241Am source to assess their performance as radiation detectors in a high-LET environment. This letter demonstrates the capability of this microdetector to be used to measure dose and LET in hadrontherapy centers for treatment plan verification as part of their patient-specific quality control program
Increase of geometrical and positional fatty acid isomers in dark meat from broilers fed heated oils
Oxidation of polyunsaturated fatty acids leads to primary and secondary oxidation products. Compounds and amounts of these products vary, depending on the oxidative conditions. As these oxidation products have different absorption and biological effects, we performed two different heating treatments on sunflower oil. The first was heating the oil at 190-195"C for 28 h i.e. very oxidised oil); and the other, heating at 60"C for 12 days (i.e. pcroxidiscd oil). In the frame of this study, we compared the fatty acid composition of a refined sunflower oil (fresh oil), the pcroxidiscd oil, the very oxidised oil, and a mixture (1+1) of fresh and very oxidised oil (i.e. oxidised oil). Oil fatty acid compositions were affected by the heating treatments. In to addition, different fatty acid isomers were formed during heating at 190-I95°C and significant differences were found between thcir.contcnt in the sunflower oils. We also studied the effect of feeding broilers with these oils and Zn and tocopherol supplements on the fatty acid composition of their raw dark meat. Various Irons fatty acid isomers increased in dark meat from broilers fed oxidised and very oxidised oils. In addition, discriminant analysis showed that ditrans-CLA content was able to distinguish dark chicken meat from chickens fed sunflower oils heated at 190-195"C
Projected multicluster model with Jastrow and linear state dependent correlations for nuclei
Variational wave functions based on a Margenau-Brink cluster model with short
range and state dependent correlations, and angular momentum projection are
obtained for some nuclei with . The calculations have been
carried out starting from the nucleon-nucleon interaction by using the
Variational Monte Carlo method. The configuration used consists of three alpha
clusters located at the apexes of an equilateral triangle, and an additional
cluster, not necessarily of alpha type, forming a tetrahedron. This cluster is
located at the top of its height. Short-range and state dependent correlations
are included by means of a central Jastrow factor and a linear operatorial
correlation factor respectively. Angular momentum projection is performed by
using the Peierls-Yoccoz operators. Optimal structures are obtained for all the
nuclei studied. Some aspects of our methodology have been tested by comparing
with previous calculations carried out without short range correlations. The
binding energy, the root mean square radius, and the one- and two-body
densities are reported. The effects of correlations on both the energy and the
nucleon distribution are analyzed systematically.Comment: 19 pages, 6 figure
A family of complex potentials with real spectrum
We consider a two-parameter non hermitean quantum-mechanical hamiltonian that
is invariant under the combined effects of parity and time reversal
transformation. Numerical investigation shows that for some values of the
potential parameters the hamiltonian operator supports real eigenvalues and
localized eigenfunctions. In contrast with other PT symmetric models, which
require special integration paths in the complex plane, our model is integrable
along a line parallel to the real axis.Comment: Six figures and four table
- …