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State-by-state cross sections for dissociative electron attachment and electron-impact dissociation for molecular oxygen are computed using ab initio resonance curves calculated with the R-matrix method. When O2 is in its vibrational ground…

Plasma Physics · Physics 2015-01-09 V. Laporta , R. Celiberto , J. Tennyson

Our knowledge about the "cold" Universe often relies on molecular spectra. A general property of such spectra is that the energy level populations are rarely at local thermodynamic equilibrium. Solving the radiative transfer thus requires…

Instrumentation and Methods for Astrophysics · Physics 2018-01-23 Jérôme Loreau , François Lique , Alexandre Faure

Resonant vibrational and rotation-vibration excitation cross sections for electron-CO scattering are calculated in the 0-10 eV energy range for all 81 vibrational states of CO, assuming that the excitation occur via the 2{\Pi} shape…

Chemical Physics · Physics 2012-08-14 V. Laporta , C. M. Cassidy , J. Tennyson , R. Celiberto

Kinetic energy and angular distributions of O$^-$ ions formed by dissociative electron attachment to CO molecule have been studied for 9, 9.5, 10, 10.5, 11, 11.5 eV incident electron energies around the resonance using time sliced velocity…

Atomic and Molecular Clusters · Physics 2015-02-10 Pamir Nag , Dhananjay Nandi

Radiative emission during cold collisions between trapped laser-cooled Rb atoms and alkaline-earth ions (Ca$^+$, Sr$^+$, Ba$^+$) and Yb$^+$, and between Li and Yb$^+$, are studied theoretically, using accurate effective-core-potential based…

Atomic Physics · Physics 2015-06-23 Humberto Da Silva , Maurice Raoult , Mireille Aymar , Olivier Dulieu

Molecular dynamics calculations of inelastic collisions of atomic oxygen with molecular nitrogen are known to show orders of magnitude discrepancies with experimental results in the range from room temperature to many thousands of degrees…

Modeling environments that are not in local thermal equilibrium, such as protoplanetary disks or planetary atmospheres, with molecular spectroscopic data from space telescopes requires knowledge of the rate coefficients of rovibrationally…

Atomic Physics · Physics 2023-10-10 Taha Selim , Ad van der Avoird , Gerrit C. Groenenboom

Vibrational-excitation cross sections of ground electronic state of carbon dioxide molecule by electron-impact through the CO2-(2\Pi) shape resonance is considered in the separation of the normal modes approximation. Resonance curves and…

Chemical Physics · Physics 2016-11-01 V. Laporta , J. Tennyson , R. Celiberto

The collision-energy resolved rate coefficient for dissociative recombination of HD+ ions in the vibrational ground state is measured using the photocathode electron target at the heavy-ion storage ring TSR. Rydberg resonances associated…

Context. Molecular hydrogen and its cation H+2 are among the first species formed in the early Universe, and play a key role in the thermal and chemical evolution of the primordial gas. In molecular clouds, H+2 ions formed through…

We present a study of vibrational quenching and chemical processes of molecular ions immersed in an ultracold atomic gas by means of the quasi-classical trajectory (QCT) method. In particular, BaRb$^+(v)$ + Rb collisions are studied at cold…

Atomic Physics · Physics 2019-02-27 Jesús Pérez-Ríos

Motivated by recent observations with Herschel/PACS, and the availability of new rate coefficients for the collisional excitation of CO (Yang et al. 2010), the excitation of warm astrophysical CO is revisited with the use of numerical and…

Astrophysics of Galaxies · Physics 2015-06-04 David A. Neufeld

Molecular fragmentation leading to the formation of negatively and positively charged hydrogen ions in 7-keV OH$^+$ + Ar collisions is investigated experimentally. The most striking finding is that negative and positive hydrogen ions are…

Energy-changing electron-hydrogen atom collisions are crucial to regulating the energy balance in astrophysical and laboratory plasmas and relevant to the formation of stellar atmospheres, recombination in H-II clouds, primordial…

Instrumentation and Methods for Astrophysics · Physics 2015-06-17 Daniel Vrinceanu , Roberto Onofrio , Hossein R. Sadeghpour

We present a theoretical description of dissociative recombination of triatomic molecular ions having large permanent dipole moments. The study has been partly motivated by a discrepancy between experimental and theoretical cross-sections…

Quantum Physics · Physics 2015-05-13 Nicolas Douguet , Viatcheslav Kokoouline , Chris H. Greene

The hydronium cation plays a crucial role in interstellar oxygen and water chemistry. While its spectroscopy was extensively investigated earlier, the collisional excitation of H$_3$O$^+$ is not well studied yet. In this work we present…

Chemical Physics · Physics 2022-11-07 S. Demes , François Lique , Alexandre Faure , Floris van der Tak , Claire Rist , Pierre Hily-Blant

Two different ab initio potential energy surfaces are employed to investigate the efficiency of the rotational excitation channels for the polar molecular ion HeH$^+$ interacting with He atoms. We further use them to investigate the quantum…

We report the derivation of rate coefficients for the rotational (de-)excitation of PO$^+$ induced by collisions with H$_2$. The calculations were performed on a four-dimensional potential energy surface, obtained on top of highly accurate…

Astrophysics of Galaxies · Physics 2023-10-13 F. Tonolo , L. Bizzocchi , V. M. Rivilla , F. Lique , M. Melosso , C. Puzzarini

The HeH$^+$ cation is the simplest molecular prototype of the indirect dissociative recombination (DR) process that proceeds through electron capture into Rydberg states of the corresponding neutral molecule. This Letter develops the first…

Chemical Physics · Physics 2020-02-05 Roman Čurík , Dávid Hvizdoš , Chris H. Greene

In the first section we present the atomic part where a C2+ atomic target was prepared and used to generate theoretical data to investigate recombination lines arising from electron-ion collisions in thin plasma. R-matrix method was used to…

Atomic Physics · Physics 2012-11-07 Taha Sochi