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Atomic negative ions are fragile quantum systems in which correlation among the valence electrons plays a very important role. For doubly excited states correlation becomes dominant. Photodetachment is the process where a negative ion…

Atomic Physics · Physics 2009-09-25 Andreas E. Klinkmueller

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

We show that density functional theory within the RPA (random phase approximation for the exchange-correlation energy) provides a correct description of bond dissociation in H$_2$ in a spin-restricted Kohn-Sham formalism, i.e. without…

Other Condensed Matter · Physics 2009-11-10 M. Fuchs , Y. -M. Niquet , X. Gonze , K. Burke

Cross sections are presented for dissociative recombination and electron-impact vibrational excitation of the ArH+ molecular ion at electron energies appropriate for the interstellar environment. The R-matrix method is employed to determine…

Astrophysics of Galaxies · Physics 2018-08-21 A. Abdoulanziz , F. Colboc , D. A. Little , Y. Moulane , J. Zs. Mezei , E. Roueff , J. Tennyson , I. F. Schneider , V. Laporta

Ultracold hybrid ion-atom traps offer the possibility of microscopic manipulation of quantum coherences in the gas using the ion as a probe. However, inelastic processes, particularly charge transfer can be a significant process of ion loss…

Atomic Physics · Physics 2015-06-19 B. M. McLaughlin , H. D. L. Lamb , I. C. Lane , J. F. McCann

Photodissociation cross sections for the SH$^+$ radical are computed from all rovibrational (RV) levels of the ground electronic state X$~^3\Sigma^-$ for wavelengths from threshold to 500~\AA. The five electronic transitions, $2~ ^3\Sigma^-…

Earth and Planetary Astrophysics · Physics 2016-05-04 E. C. McMillan , G. Shen , J. F. McCann , B. M. McLaughlin , P. C. Stancil

We report on the observation of blue-detuned photoassociation in Rb2, in which vibrational levels are energetically above the corresponding excited atomic asymptote. 85Rb atoms in a MOT were photoassociated at short internuclear distances…

Total and partial cross sections for breakup of ground rovibronic state of H$_2^+$by photon impact are calculated using the exact nonadiabatic nonrelativistic Hamiltonian without approximation. The converged results span six orders of…

Chemical Physics · Physics 2013-08-09 Daniel J. Haxton

We investigate the dynamics of the photodissociation of the hydrohelium cation HeH$^+$ by XUV radiation with the aim to establish a detailed comparison with a recent experimental work carried out at the FLASH free electron laser using both…

Atomic Physics · Physics 2015-05-28 J. Loreau , J. Lecointre , X. Urbain , N. Vaeck

A detailed theory-versus-experiment comparison is worked out for H$_2^+$ intense laser dissociation, based on angularly resolved photodissociation spectra recently recorded in H.Figger's group. As opposite to other experimental setups, it…

Quantum Physics · Physics 2009-11-10 Vassili Serov , Arne Keller , Osman Atabek , Nicolas Billy

We present measurements of the total projectile-electron-loss cross sections in O$^-$ + N$_2$ collisions in the energy range from 2.5 to 8.5 keV. Two different techniques, beam attenuation and the growth rate, are employed. The difference…

Atomic Physics · Physics 2026-02-17 A. A. Martínez , M. M. Sant'Anna , G. Hinojosa

Motivated by the huge need of data for non-equilibrium plasma modeling, a theoretical investigation of dissociative electron attachment to the NO molecule is performed. The calculations presented here are based on the…

Atomic Physics · Physics 2020-12-02 V. Laporta , I. F. Schneider , J. Tennyson

We report on an energy-sensitive imaging detector for studying the fragmentation of polyatomic molecules in the dissociative recombination of fast molecular ions with electrons. The system is based on a large area (10 cm x 10 cm)…

Complete dissociation dynamics of low-energy electron attachment to carbon disulfide have been studied using the velocity slice imaging (VSI) technique. The ion yields of S- and CS- fragment ions as the function of incident electron energy…

Atomic and Molecular Clusters · Physics 2022-09-28 Anirban Paul , Dhananjay Nandi

We report the results of a first-principles study of dissociative electron attachment to H2O. The cross sections are obtained from nuclear dynamics calculations carried out in full dimensionality within the local complex potential model by…

Chemical Physics · Physics 2007-10-10 Daniel J. Haxton , T. N. Rescigno , C. W. McCurdy

We calculate accurate potential energy curves for a ground-state He$^+$ ion interacting with a He atom in the lowest-energy metastable $^3\!S$ electronic state. We employ the full configuration interaction method, equivalent to exact…

Atomic Physics · Physics 2023-11-30 Jacek Gȩbala , Michał Przybytek , Marcin Gronowski , Michał Tomza

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…

Triatomic cation $^{175}$LuOH$^+$, featuring near-degenerate, opposite-parity $l$-doublets, offers enhanced sensitivity to $\mathcal{P}$- and $\mathcal{T}$-violating interactions. We present \emph{ab initio} calculations of its electronic…

Chemical Physics · Physics 2025-08-22 Igor Kurchavov , Sergey Prosnyak , Leonid V. Skripnikov , Alexander Petrov

The structural, vibrational, energetic and electronic properties of hydrogen at the stoichiometric RuO2(110) termination are studied using density functional theory. The oxide surface is found to stabilize both molecular and dissociated H2.…

Materials Science · Physics 2007-05-23 Qiang Sun , Karsten Reuter , Matthias Scheffler

The cross section for dissociative recombination of BeH^+ is calculated by solution of the time-dependent Schrodinger equation in the local complex potential approximation. The effects of couplings between resonant states and the Rydberg…

Atomic Physics · Physics 2009-04-02 J. B. Roos , M. Larsson , AA. Larson , A. E Orel