2,634 research outputs found
Grids of stellar models. VIII. From 0.4 to 1.0 Msun at Z=0.020 and Z=0.001, with the MHD equation of state
We present stellar evolutionary models covering the mass range from 0.4 to 1
Msun calculated for metallicities Z=0.020 and 0.001 with the MHD equation of
state (Hummer & Mihalas, 1988; Mihalas et al. 1988; D\"appen et al. 1988). A
parallel calculation using the OPAL (Rogers et al. 1996) equation of state has
been made to demonstrate the adequacy of the MHD equation of state in the range
of 1.0 to 0.8 Msun (the lower end of the OPAL tables). Below, down to 0.4 Msun,
we have justified the use of the MHD equation of state by theoretical arguments
and the findings of Chabrier & Baraffe (1997).
We use the radiative opacities by Iglesias & Rogers (1996), completed with
the atomic and molecular opacities by Alexander & Fergusson (1994). We follow
the evolution from the Hayashi fully convective configuration up to the red
giant tip for the most massive stars, and up to an age of 20 Gyr for the less
massive ones. We compare our solar-metallicity models with recent models
computed by other groups and with observations.
The present stellar models complete the set of grids computed with the same
up-to-date input physics by the Geneva group [Z=0.020 and 0.001, Schaller et
al. (1992), Bernasconi (1996), and Charbonnel et al. (1996); Z=0.008, Schaerer
et al. (1992); Z=0.004, Charbonnel et al. (1993); Z=0.040, Schaerer et al.
(1993); Z=0.10, Mowlavi et al. (1998); enhanced mass loss rate evolutionary
tracks, Meynet et al. (1994)].Comment: Accepted for publication in A&A Supplement Serie
Nuclear quantum effects in ab initio dynamics: theory and experiments for lithium imide
Owing to their small mass, hydrogen atoms exhibit strong quantum behavior
even at room temperature. Including these effects in first principles
calculations is challenging, because of the huge computational effort required
by conventional techniques. Here we present the first ab-initio application of
a recently-developed stochastic scheme, which allows to approximate nuclear
quantum effects inexpensively. The proton momentum distribution of lithium
imide, a material of interest for hydrogen storage, was experimentally measured
by inelastic neutron scattering experiments and compared with the outcome of
quantum thermostatted ab initio dynamics. We obtain favorable agreement between
theory and experiments for this purely quantum mechanical property, thereby
demonstrating that it is possible to improve the modelling of complex
hydrogen-containing materials without additional computational effort
Photoelasticity of sodium silicate glass from first principles
Based on density-functional perturbation theory we have computed the
photoelastic tensor of a model of sodium silicate glass of composition
(NaO)(SiO) (NS3). The model (containig 84 atoms) is
obtained by quenching from the melt in combined classical and Car-Parrinello
molecular dynamics simulations. The calculated photoelastic coefficients are in
good agreement with experimental data. In particular, the calculation
reproduces quantitatively the decrease of the photoelastic response induced by
the insertion of Na, as measured experimentally.
The extension to NS3 of a phenomenological model developed in a previous work
for pure a-SiO indicates that the modulation upon strain of other
structural parameters besides the SiOSi angles must be invoked to explain the
change in the photoelstic response induced by Na
The H+ ATPase regulatory subunit of Methanococcus thermolithotrophicus: Amplification of an 800 bp fragment by polymerase chain reaction
AbstractAn 800 bp fragment of Methanococcus thermolithotrophicus genomic DNA was amplified by the polymerase chain reaction method using primers designed from conserved regions of the V-type H+ ATPase regulatory subunits from the archaebacterium Sulfolobus, and several eukaryotes. Although more than one product was obtained, only one of them had the expected size and was exclusively amplified in the presence of the left and right primers. The DNA and the deduced protein sequences of the putative Methanococcus H+ ATPase subunit revealed homology to the corresponding sequences in Sulfolobus and eukaryotes (about 60% identical residues) and a less evident homology to the eubacterial F1 -ATPase α-subunit (22% identical residues with E. coli)
Electron-phonon interaction in the solid form of the smallest fullerene C
The electron-phonon coupling of a theoretically devised carbon phase made by
assembling the smallest fullerenes C is calculated from first
principles. The structure consists of C cages in an {\it fcc} lattice
interlinked by two bridging carbon atoms in the interstitial tetrahedral sites
({\it fcc}-C). The crystal is insulating but can be made metallic by
doping with interstitial alkali atoms. In the compound NaC the
calculated coupling constant is 0.28 eV, a value much larger
than in C, as expected from the larger curvature of C. On the
basis of the McMillan's formula, the calculated =1.12 and a
assumed in the range 0.3-0.1 a superconducting T in the range 15-55 K is
predicted.Comment: 7 page
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