Comparison of Global and Local Adaptive Coordinates for Density Functional Calculations

A globally-adaptive curvilinear coordinate formalism is shown to be easily convertible to a class of curvilinear transformations locally optimized around atom sites by a few parameters. Parameter transferability is established for a demanding test case, and the results of the two methods are shown to be comparable. Computational efficiencies realized in the local method are discussed.Comment: 21 pages, 4 figure

Weak magnetic fields in central stars of planetary nebulae?

It is not yet clear whether magnetic fields play an essential role in shaping planetary nebulae (PNe), or whether stellar rotation alone and/or a close binary companion can account for the variety of the observed nebular morphologies. In a quest for empirical evidence verifying or disproving the role of magnetic fields in shaping PNe, we follow up on previous attempts to measure the magnetic field in a representative sample of PN central stars. We obtained low-resolution polarimetric spectra with FORS 2 at VLT for a sample of twelve bright central stars of PNe with different morphology, including two round nebulae, seven elliptical nebulae, and three bipolar nebulae. Two targets are Wolf-Rayet type central stars. For the majority of the observed central stars, we do not find any significant evidence for the existence of surface magnetic fields. However, our measurements may indicate the presence of weak mean longitudinal magnetic fields of the order of 100 Gauss in the central star of the young elliptical planetary nebula IC 418, as well as in the Wolf-Rayet type central star of the bipolar nebula Hen2-113 and the weak emission line central star of the elliptical nebula Hen2-131. A clear detection of a 250 G mean longitudinal field is achieved for the A-type companion of the central star of NGC 1514. Some of the central stars show a moderate night-to-night spectrum variability, which may be the signature of a variable stellar wind and/or rotational modulation due to magnetic features. We conclude that strong magnetic fields of the order of kG are not widespread among PNe central stars. Nevertheless, simple estimates based on a theoretical model of magnetized wind bubbles suggest that even weak magnetic fields below the current detection limit of the order of 100 G may well be sufficient to contribute to the shaping of PNe throughout their evolution.Comment: 16 pages, 11 figures, 3 tables, accepted for publication in A&A; References updated, minor correction

Nominal plurals in Sign Language of the Netherlands: Accounting for allomorphy and variation

n both signed and spoken languages, reduplication is a common process in the formation of morphologically complex structures, expressing, e.g., plurality and certain aspectual meanings. A framework in which spoken language reduplication has been formalized frequently is Optimality Theory (OT). While an important attribute of OT-constraints is their universality, to date, the question to what extent such constraints are modality-independent, and thus work for sign language reduplication as well, remains largely unanswered. In the present study, we offer the first OT-formalization of plural reduplication in Sign Language of the Netherlands (NGT). The NGT-data reveal that this language features different plural allomorphs, the choice of which depends on phonological properties of the base noun. However, we also identify variation, e.g., all noun types allow for zero marking.In our formalization, we aim to introduce constraints that are maximally modality-independent, using constraint types that have previously been proposed for spoken language reduplication. Our formalization is the first to take into account base-reduplicant faithfulness for a sign language, and also the first to account for variation in sign language data by employing stochastic OT, whereby some noise is added to the ranking value of each constraint at evaluation time. Evaluating the modality-(in)dependence of our proposed account suggests that the types of constraints we employ as well as the evaluation in the spirit of stochastic OT are not specific to a modality, while the featural implementation is inevitably modality-dependent

Low-metallicity massive single stars with rotation. II. Predicting spectra and spectral classes of chemically-homogeneously evolving stars

Context. Metal-poor massive stars are supposed to be progenitors of certain supernovae, gamma-ray bursts and compact object mergers, potentially contributing to the early epochs of the Universe with their strong ionizing radiation. However, they remain mainly theoretical as individual spectroscopic observations of such objects have rarely been carried out below the metallicity of the SMC. Aims. This work aims at exploring what our state-of-the-art theories of stellar evolution combined with those of stellar atmospheres predict about a certain type of metal-poor (0.02 Z$_{\odot}$) hot massive stars, the chemically homogeneously evolving ones, called TWUIN stars. Methods. Synthetic spectra corresponding to a broad range in masses (20-130 M$_{\odot}$) and covering several evolutionary phases from the zero-age main-sequence up to the core helium-burning stage were computed. Results. We find that TWUIN stars show almost no emission lines during most of their {core hydrogen-burning} lifetimes. Most metal lines are completely absent, including nitrogen. During their core helium-burning stage, lines switch to emission and even some metal lines (oxygen and carbon, but still almost no nitrogen) show up. Mass loss and clumping play a significant role in line-formation in later evolutionary phases, particularly during core helium-burning. Most of our spectra are classified as an early O type giant or supergiant, and we find Wolf-Rayet stars of type WO in the core helium-burning phase. Conclusions. An extremely hot, early O type star observed in a low-metallicity galaxy could be the outcome of chemically homogeneous evolution $-$ and therefore the progenitor of a long-duration gamma-ray burst or a type Ic supernova. TWUIN stars may play an important role in reionizing the Universe due to their being hot without showing prominent emission lines during the majority of their lifetimes.Comment: Accepted by Astronomy and Astrophysics. In Pres

Wind ionization structure of the short-period eclipsing LMC Wolf-Rayet binary BAT99-129: preliminary results

BAT99-129 is a rare, short-period eclipsing Wolf-Rayet binary in the Large Magellanic Cloud. We present here medium-resolution NTT/EMMI spectra that allow us to disentangle the spectra of the two components and find the orbital parameters of the binary. We also present VLT/FORS1 spectra of this binary taken during the secondary eclipse, i.e. when the companion star passes in front of the Wolf-Rayet star. With these data we are able to extract, for the first time in absolute units for a WR+O binary, the sizes of the line emitting regions.Comment: 6 pages, 5 figures, to appear in proc. of "Close Binaries in the 21st Century: New Opportunities and Challenges", 2005 - Corrected Figure

The Wolf-Rayet stars in the Large Magellanic Cloud: A comprehensive analysis of the WN class

Aims: Following our comprehensive studies of the WR stars in the Milky Way, we now present spectroscopic analyses of almost all known WN stars in the LMC. Methods: For the quantitative analysis of the wind-dominated emission-line spectra, we employ the Potsdam Wolf-Rayet (PoWR) model atmosphere code. By fitting synthetic spectra to the observed spectral energy distribution and the available spectra (ultraviolet and optical), we obtain the physical properties of 107 stars. Results: We present the fundamental stellar and wind parameters for an almost complete sample of WN stars in the LMC. Among those stars that are putatively single, two different groups can be clearly distinguished. While 12% of our sample are more luminous than 10^6 Lsun and contain a significant amount of hydrogen, 88% of the WN stars, with little or no hydrogen, populate the luminosity range between log (L/Lsun) = 5.3...5.8. Conclusions: While the few extremely luminous stars (log (L/Lsun) > 6), if indeed single stars, descended directly from the main sequence at very high initial masses, the bulk of WN stars have gone through the red-supergiant phase. According to their luminosities in the range of log (L/Lsun) = 5.3...5.8, these stars originate from initial masses between 20 and 40 Msun. This mass range is similar to the one found in the Galaxy, i.e. the expected metallicity dependence of the evolution is not seen. Current stellar evolution tracks, even when accounting for rotationally induced mixing, still partly fail to reproduce the observed ranges of luminosities and initial masses. Moreover, stellar radii are generally larger and effective temperatures correspondingly lower than predicted from stellar evolution models, probably due to subphotospheric inflation.Comment: 17+46 pages; 10+54 figures; v2: typos corrected, space-saving layout for appendix C, published in A&

Highly Ionized Collimated Outflow from HE 0238 - 1904

We present a detailed analysis of a highly ionized, multiphased and collimated outflowing gas detected through O V, O VI, Ne VIII and Mg X absorption associated with the QSO HE 0238 - 1904 (z_em ~ 0.629). Based on the similarities in the absorption line profiles and estimated covering fractions, we find that the O VI and Ne VIII absorption trace the same phase of the absorbing gas. Simple photoionization models can reproduce the observed N(Ne VIII), N(O VI) and N(Mg X) from a single phase whereas the low ionization species (e.g. N III, N IV, O IV) originate from a different phase. The measured N(Ne VIII)/N(O VI) ratio is found to be remarkably similar (within a factor of ~ 2) in several individual absorption components kinematically spread over ~ 1800 km/s. Under photoionization this requires a fine tuning between hydrogen density (nH) and the distance of the absorbing gas from the QSO. Alternatively this can also be explained by collisional ionization in hot gas with T > 10^{5.7} K. Long-term stability favors the absorbing gas being located outside the broad line region (BLR). We speculate that the collimated flow of such a hot gas could possibly be triggered by the radio jet interaction.Comment: Minor revision (accepted for publication in MNRAS letter

Variational quantum Monte Carlo calculations for solid surfaces

Quantum Monte Carlo methods have proven to predict atomic and bulk properties of light and non-light elements with high accuracy. Here we report on the first variational quantum Monte Carlo (VMC) calculations for solid surfaces. Taking the boundary condition for the simulation from a finite layer geometry, the Hamiltonian, including a nonlocal pseudopotential, is cast in a layer resolved form and evaluated with a two-dimensional Ewald summation technique. The exact cancellation of all Jellium contributions to the Hamiltonian is ensured. The many-body trial wave function consists of a Slater determinant with parameterized localized orbitals and a Jastrow factor with a common two-body term plus a new confinement term representing further variational freedom to take into account the existence of the surface. We present results for the ideal (110) surface of Galliumarsenide for different system sizes. With the optimized trial wave function, we determine some properties related to a solid surface to illustrate that VMC techniques provide standard results under full inclusion of many-body effects at solid surfaces.Comment: 9 pages with 2 figures (eps) included, Latex 2.09, uses REVTEX style, submitted to Phys. Rev.