Tensorial depolarization of alkali atoms by isotropic collisions with neutral hydrogen

Results. We consider the problem of isotropic collisions between an alkali atom and neutral hydrogen. We calculate the collisional tensorial components of general p and s-states, characterized by their effective principal quantum number $n^{*}$. It is found that the behaviour of the tensorial components obey simple power laws allowing quick calculations of the depolarizing collisional rates. As application, our results should allow a rigorous treatment of the atomic polarization profiles of the D1 -D2 lines of alkali atoms. Conclusions. Close coupling treatments of atomic collisions are needed to decipher the information encoded in the polarized radiation from the Sun. Important problems remain unresolved like the role of collisions in the Paschen-Back conditions.Comment: Accepted for publication in A&

Peptide Bonds in the Interstellar Medium: Facile Autocatalytic Formation from Nitriles on Water-Ice Grains

A recent suggestion that acetamide, \ce{CH3C(O)NH2}, could be readily formed on water-ice grains by the acid induced addition of water across the \ce{CN} bond is now shown to be valid. Computational modelling of the reaction between \ce{R-CN} (R = H, \ce{CH3}) and a cluster of 32 molecules of water and one \ce{H3O+} proceeds auto-catalytically to form firstly a hydroxy imine \ce{R-C(OH)=NH} and secondly an amide \ce{R-C(O)NH2}. Quantum mechanical tunnelling, computed from small-curvature estimates, plays a key role in the rates of these reactions. This work represents the first credible effort to show how amides can be formed from abundant substrates, namely nitriles and water, reacting on a water-ice cluster containing catalytic amounts of hydrons in the interstellar medium with consequential implications towards the origins of life.Comment: 19 pages, 8 Figure

Polarized line formation with J-state interference in the presence of magnetic fields: A heuristic treatment of collisional frequency redistribution

An expression for the partial frequency redistribution (PRD) matrix for line scattering in a two-term atom, which includes the J-state interference between its fine structure line components is derived. The influence of collisions (both elastic and inelastic) and an external magnetic field on the scattering process is taken into account. The lower term is assumed to be unpolarized and infinitely sharp. The linear Zeeman regime in which the Zeeman splitting is much smaller than the fine structure splitting is considered. The inelastic collision rates between the different levels are included in our treatment. We account for the depolarization caused by the collisions coupling the fine structure states of the upper term, but neglect the polarization transfer between the fine structure states. When the fine structure splitting goes to zero, we recover the redistribution matrix that represents the scattering on a two-level atom (which exhibits only m-state interference --- namely the Hanle effect). The way in which the multipolar index of the scattering atom enters into the expression for the redistribution matrix through the collisional branching ratios is discussed. The properties of the redistribution matrix are explored for a single scattering process for an L=0 to 1 to 0 scattering transition with S=1/2 (a hypothetical doublet centered at 5000 A and 5001 A). Further, a method for solving the Hanle radiative transfer equation for a two-term atom in the presence of collisions, PRD, and J-state interference is developed. The Stokes profiles emerging from an isothermal constant property medium are computed.Comment: Accepted for publication in Journal of Quantitative Spectroscopy and Radiative Transfer (JQSRT

Polycyclic Aromatic Hydrocarbons in Seyfert and star-forming galaxies

Polycyclic Aromatic Hydrocarbons (PAHs) are carbon-based molecules resulting from the union of aromatic rings and related species, which are likely responsible for strong infrared emission features (3.3, 6.2, 7.7, 8.6, 11.3 and 12.7 microns). In this work, using a sample of 50 Seyfert galaxies (DL<100 Mpc) we compare the circumnuclear (inner kpc) PAH emission of AGN to that of a control sample of star-forming galaxies (22 luminous infrared galaxies and 30 HII galaxies), and investigate the differences between central and extended PAH emission. Using Spitzer/InfraRed Spectrograph spectral data of Seyfert and star-forming galaxies and newly developed PAH diagnostic model grids, derived from theoretical spectra, we compare the predicted and observed PAH ratios. We find that star-forming galaxies and AGN-dominated systems are located in different regions of the PAH diagnostic diagrams. This suggests that not only are the size and charge of the PAH molecules different, but also the nature and hardness of the radiation field that excite them. We find tentative evidence that PAH ratios in AGN-dominated systems are consistent with emission from larger PAH molecules (Nc>300-400) as well as neutral species. By subtracting the spectrum of the central source from the total, we compare the PAH emission in the central vs extended region of a small sample of AGN. In contrast to the findings for the central regions of AGN-dominated systems, the PAH ratios measured in the extended regions of both type 1 and type 2 Seyfert galaxies can be explained assuming similar PAH molecular size distribution and ionized fractions of molecules to those seen in central regions of star-forming galaxies (100<Nc<300).Comment: 29 pages, 21 figures, 6 tables, MNRAS, accepted 2021 October 2

Collisional depolarization and transfer rates of spectral lines by atomic hydrogen. IV: application to ionised atoms

The semi-classical theory of collisional depolarization of spectral lines of neutral atoms by atomic hydrogen (Derouich et al. 2003a; Derouich et al. 2003b; Derouich et al. 2004 and references therein) is extended to spectral lines of singly ionised atoms. In this paper we apply our general method to the particular cases of the 3d $^2D$ and $4p$ $^2P$ states of the CaII ion and to the $5p$ $^2P$ state of the SrII ion. Analytical expressions of all rates as a function of local temperature are given. Our results for the CaII ion are compared to recent quantum chemistry calculations. A discussion of our results is presented.Comment: 19 pages, 14 figures, submitted to Astronomy and Astrophysic

Collisional depolarization and transfer rates of spectral lines by atomic hydrogen. II: application to d states of neutral atoms

The theory of collisional depolarization of spectral lines by atomic hydrogen (Derouich et al. \cite{derouich1}) is extended to $d$ $(l$=2) atomic levels. Depolarization rates, polarization and population transfer rates are calculated and results are given as a function of the temperature. Cross sections as a function of the effective quantum number for a relative velocity of 10 $\textrm{km s}^{-1}$ are also given together with velocity exponents $\lambda$, if \textbf{they exist}, on the assumption that the cross section varies with velocity as $v^{-\lambda}$. A discussion of our results is presented.Comment: 11 pages including 3 figures and 2 tables, accepted in A&

Association of homocysteine and methylene tetrahydrofolate reductase (MTHFR C677T) gene polymorphism with coronary artery disease (CAD) in the population of North India

The implications of the methylene tetrahydrofolate reductase (MTHFR) gene and the level of homocysteine in the pathogenesis of coronary artery disease (CAD) have been extensively studied in various ethnic groups. Our aim was to discover the association of MTHFR (C677T) polymorphism and homocysteine level with CAD in north Indian subjects. The study group consisted of 329 angiographically proven CAD patients, and 331 age and sex matched healthy individuals as controls. MTHFR (C677T) gene polymorphism was detected based on the polymerase chain reaction and restriction digestion with HinfI. Total homocysteine plasma concentration was measured using immunoassay. T allele frequency was found to be significantly higher in patients than in the control group. We found significantly elevated levels of mean homocysteine in the patient group when compared to the control group (p = 0.00). Traditional risk factors such as diabetes, hypertension, smoking habits, a positive family history and lipid profiles (triglyceride, total cholesterol, HDL-cholesterol, LDL-cholesterol, VLDL-cholesterol), were found significantly associated through univariate analysis. Furthermore, multivariable logistics regression analysis revealed that CAD is significantly and variably associated with diabetes, hypertension, smoking, triglycerides and HDL-cholesterol. Our findings showed that MTHFR C677T polymorphism and homocysteine levels were associated with coronary artery disease in the selected population