相关论文: ArH2+ and NeH2+ as Global Minima in the Ar+/Ne+ + …
The first identification of the argonium ion (ArH+) towards the Crab Nebula supernova remnant was proclaimed by the Herschel in the sub-millimeter and far-infrared domain. Very recently the discovery of the hydro-helium cation (HeH+) in the…
One of the surprises of the Herschel mission was the detection of ArH+ towards the Crab Nebula in emission and in absorption towards strong Galactic background sources. Although these detections were limited to the first quadrant of the…
We have performed combined photoionization and photodissociation region (PDR) modelling of a Crab Nebula filament subjected to the synchrotron radiation from the central pulsar wind nebula, and to a high flux of charged particles; a greatly…
Aims. Following the recent detection of 36ArH+ in the Crab nebula spectrum, we have computed the photodissociation rate of ArH+ in order to constrain the physical processes at work in this environment. Methods. Photodissociation cross…
Noble gas molecules have not hitherto been detected in space. From spectra obtained with the Herschel Space Observatory, we report the detection of emission in the 617.5 GHz and 1234.6 GHz J = 1-0 and 2-1 rotational lines of {36}ArH^+ at…
{\bf R}-matrix calculations combined with the adiabatic nuclei approximation are used to compute electron-impact rotiational excitation rates for three closed-shell diatomic cations, HeH$^+$, CH$^+$, ArH$^+$. Comparisons with previous…
From four independent calculations using three different theoretical approaches, rate coefficients for the formation of HeH$^+$ via the radiative association of He$^+$ and H were computed. Good agreement is found between our new…
Potential and dipole moment curves for the CrH(X$^6\Sigma^+$) molecule were obtained at the internally-contracted multi-reference configuration interaction with single and double excitations and Davidson correction (ic-MRCISD+Q) level using…
Recent observations of H2 and H3+ in diffuse interstellar sightlines revealed a difference in the nuclear spin excitation temperatures of the two species. This discrepancy comes as a surprise, as H3+ and H2 should undergo frequent…
The sheer interstellar abundance of helium makes any bound molecules or complexes containing it of potential interest for astrophysical observation. This work utilizes high-level and trusted quantum chemical techniques to predict the…
We have investigated the chemistry of ${\rm C + H_3^+}$ forming CH$^+$, CH$_2^+$, and CH$_3^+$. These reactions are believed to be some of the key gas-phase astrochemical processes initiating the formation of organic molecules in molecular…
The internal energy available in vibrationally excited H2 molecules can be used to overcome or diminish the activation barrier of various chemical reactions of interest for molecular astrophysics. In this article we investigate in detail…
Along several sight lines within the Milky Way ArH+ has been ubiquitously detected with only one detection in extragalactic environments, namely along two sight lines in the red shift z=0.89 absorber towards the lensed blazar PKS 1830-211.…
The rate constants for the formation, destruction, and collisional excitation of SH$^+$ are calculated from quantum mechanical approaches using two new SH$_2^+$ potential energy surfaces (PESs) of $^4A''$ and $^2A''$ electronic symmetry.…
We used K-band spectra to measure the H2 excitation temperatures in six molecular knots associated with the filaments in the Crab Nebula. The temperatures are quite high - in the range T ~ 2000-3000K, just below the H2 dissociation…
The protonated Argon ion, $^{36}$ArH$^{+}$, has been identified recently in the Crab Nebula (Barlow et al. 2013) from Herschel spectra. Given the atmospheric opacity at the frequency of its $J$=1-0 and $J$=2-1 rotational transitions (617.5…
Sulfur is essential for life, but its abundance and distribution in the interstellar medium remain uncertain, with over 90% of sulfur undetected in cold molecular clouds. Sulfur allotropes (S$_{\rm n}$) have been proposed as possible…
Understanding how molecules and dust might have formed within a rapidly expanding young supernova remnant is important because of the obvious application to vigorous supernova activity at very high redshift. In previous papers, we found…
We have performed a theoretical investigation of the S$^+$($^4$S) + SiH$_{2}$($^1$A$_1$) reaction, a possible formation route of the HSiS$^+$ and SiSH$^+$ cations that are alleged to be precursors of interstellar silicon sulfide, SiS.…
Rate constants for the N + C2 reaction have been measured in a continuous supersonic flow reactor over the range 57 K to 296 K by the relative rate technique employing the N + OH - H + NO reaction as a reference. Excess concentrations of…