Electronic structure and chemical bonding in Ti2AlC investigated by soft x-ray emission spectroscopy

The electronic structure of the nanolaminated transition metal carbide Ti2AlC has been investigated by bulk-sensitive soft x-ray emission spectroscopy. The measured Ti L, C K and Al L emission spectra are compared with calculated spectra using ab initio density-functional theory including dipole matrix elements. The detailed investigation of the electronic structure and chemical bonding provides increased understanding of the physical properties of this type of nanolaminates. Three different types of bond regions are identified; the relatively weak Ti 3d - Al 3p hybridization 1 eV below the Fermi level, and the Ti 3d - C 2p and Ti 3d - C 2s hybridizations which are stronger and deeper in energy are observed around 2.5 eV and 10 eV below the Fermi level, respectively. A strongly modified spectral shape of the 3s final states in comparison to pure Al is detected for the buried Al monolayers indirectly reflecting the Ti 3d - Al 3p hybridization. The differences between the electronic and crystal structures of Ti2AlC, Ti3AlC2 and TiC are discussed in relation to the number of Al layers per Ti layer in the two former systems and the corresponding change of the unusual materials properties.Comment: 14 pages, 7 figures; PACS:78.70.En, 71.15.Mb, 71.20.-

Oscillator Strengths and Damping Constants for Atomic Lines in the J and H Bands

We have built a line list in the near-infrared J and H bands (1.00-1.34, 1.49-1.80 um) by gathering a series of laboratory and computed line lists. Oscillator strengths and damping constants were computed or obtained by fitting the solar spectrum. The line list presented in this paper is, to our knowledge, the most complete one now available, and supersedes previous lists.Comment: Accepted, Astrophysical Journal Supplement, tentatively scheduled for the Sep. 1999 Vol. 124 #1 issue. Text and tables also available at http://www.iagusp.usp.br/~jorge

HE 0557-4840 - Ultra-Metal-Poor and Carbon-Rich

We report the discovery and high-resolution, high S/N, spectroscopic analysis of the ultra-metal-poor red giant HE 0557-4840, which is the third most heavy-element deficient star currently known. Its atmospheric parameters are T_eff = 4900 K, log g = 2.2, and [Fe/H]= -4.75. This brings the number of stars with [Fe/H] < -4.0 to three, and the discovery of HE 0557-4840 suggests that the metallicity distribution function of the Galactic halo does not have a "gap" between [Fe/H] = -4.0, where several stars are known, and the two most metal-poor stars, at [Fe/H] ~ -5.3. HE 0557-4840 is carbon rich - [C/Fe] = +1.6 - a property shared by all three objects with [Fe/H] < -4.0, suggesting that the well-known increase of carbon relative to iron with decreasing [Fe/H] reaches its logical conclusion - ubiquitous carbon richness - at lowest abundance. We also present abundances (nine) and limits (nine) for a further 18 elements. For species having well-measured abundances or strong upper limits, HE 0557-4840 is "normal" in comparison with the bulk of the stellar population at [Fe/H] ~ -4.0 - with the possible exception of Co. We discuss the implications of these results for chemical enrichment at the earliest times, in the context of single ("mixing and fallback") and two-component enrichment models. While neither offers a clear solution, the latter appears closer to the mark. Further data are required to determine the oxygen abundance and improve that of Co, and hence more strongly constrain the origin of this object.Comment: Submitted to Astrophysical Journal. 52 pages (41 text, 11 figures

Comparative Modelling of the Spectra of Cool Giants

Our ability to extract information from the spectra of stars depends on reliable models of stellar atmospheres and appropriate techniques for spectral synthesis. Various model codes and strategies for the analysis of stellar spectra are available today. We aim to compare the results of deriving stellar parameters using different atmosphere models and different analysis strategies. The focus is set on high-resolution spectroscopy of cool giant stars. Spectra representing four cool giant stars were made available to various groups and individuals working in the area of spectral synthesis, asking them to derive stellar parameters from the data provided. The results were discussed at a workshop in Vienna in 2010. Most of the major codes currently used in the astronomical community for analyses of stellar spectra were included in this experiment. We present the results from the different groups, as well as an additional experiment comparing the synthetic spectra produced by various codes for a given set of stellar parameters. Similarities and differences of the results are discussed. Several valid approaches to analyze a given spectrum of a star result in quite a wide range of solutions. The main causes for the differences in parameters derived by different groups seem to lie in the physical input data and in the details of the analysis method. This clearly shows how far from a definitive abundance analysis we still are.Comment: accepted for publication in A&A. This version includes also the online tables. Reference spectra will later be available via the CD

Near-Infrared Classification Spectroscopy: H-band Spectra of Fundamental MK Standards

We present a catalogue of H-band spectra for 85 stars of approximately solar abundance observed at a resolving power of 3000 with the KPNO Mayall 4m FTS. The atlas covers spectral types O7-M5 and luminosity classes I-V as defined on the MK system. We identify both atomic and molecular indices and line-ratios which are temperature and luminosity sensitive allowing spectral classification to be carried out in the H-band. The line ratios permit spectral classification in the presence of continuum excess emission, which is commonly found in pre-main sequence and evolved stars. We demonstrate that with spectra of R = 1000 obtained at SNR > 50 it is possible to derive spectral types within +- 2 subclasses for late-type stars. These data are available electronically through the Astronomical Data Center in addition to being served on the World-Wide-Web.Comment: To appear in the November 20, 1998 issue of ApJ (Volume 508, #1