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Related papers: Selective Bond-Breaking in Formic Acid by Dissocia…

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Stereo-dynamics of dissociative electron attachments to CO_2 is investigated by the O^- anion velocity imaging experiments combined with the R-matrix calculations. ^2{\Pi}_g as a Feshbach resonant state of CO_2^- is confirmed to play roles…

Chemical Physics · Physics 2011-10-31 Bin Wu , Lei Xia , Yong-Feng Wang , Hong-Kai Li , Xian-Jin Zeng , Shan Xi Tian

We relate the phase separation observed in many crystals with pronounced electron correlations to the regions of negative electron compressibility. They were found in several models describing strong electron correlations. At low…

Strongly Correlated Electrons · Physics 2022-10-25 Alexei Sherman

The accurate calculation of the (differential) correlation energy is central to the quantum chemical description of bond-formation and bond-dissociation processes. In order to estimate the quality of single- and multi-reference approaches…

Chemical Physics · Physics 2013-07-16 Katharina Boguslawski , Pawel Tecmer , Gergely Barcza , Ors Legeza , Markus Reiher

Fragmentation of highly charged molecular ions or clusters consisting of more than two atoms can proceed in an onestep synchronous manner where all bonds break simultaneously or sequentially by emitting one ion after the other. We separated…

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

Dissociative electron attachment (DEA) to the HNC$_3$ is modeled theoretically using a first-principles approach. In HNC$_3$+$e^-$ collisions, there is a low-energy resonance, which has a repulsive character along the H+NC$_3$ coordinate…

The optical emission spectrum of acetylene excited by monoenergetic electrons was studied in the range of 190 nm to 660 nm. The dissociative excitation and dissociative ionization associated with excitation of the ions initiated by electron…

Atomic Physics · Physics 2022-12-12 Juraj Országh , Marián Danko , Peter Čechvala , Štefan Matejčík

The ground-state energy and density of four low-energy conformations of the formic acid dimer were calculated via Partition Density Functional Theory (PDFT). The differences between isolated and PDFT monomer densities display similar…

Chemical Physics · Physics 2018-09-25 Sara Gómez , Yan Oueis , Albeiro Restrepo , Adam Wasserman

We use transient absorption spectroscopy to monitor the ionization and dissociation products following two-photon excitation of pure liquid water. The two decay mechanisms occur with similar yield for an excitation energy of 9.3 eV, whereas…

Chemical Physics · Physics 2009-11-13 Christopher G. Elles , Ilya A. Shkrob , Robert A. Crowell , Stephen E. Bradforth

Complete dissociation dynamics of low energy electron attachment to nitrogen dioxide around 8.5 eV resonance has been studied using a velocity map imaging (VMI) spectrometer. Besides the three prominent resonant peaks at around 1.4 eV, 3.1…

Atomic and Molecular Clusters · Physics 2023-04-25 Anirban Paul , Dipayan Biswas , Dhananjay Nandi

As part of a far-infrared (FIR) spectral scan with Herschel/PACS, we present the first detection of the hydroxyl radical (OH) towards the Orion Bar photodissociation region (PDR). Five OH rotational Lambda-doublets involving energy levels…

Astrophysics of Galaxies · Physics 2015-05-28 J. R. Goicoechea , C. Joblin , A. Contursi , O. Berne , J. Cernicharo , M. Gerin , J. Le Bourlot , E. A. Bergin , T. A. Bell , M. Rollig

We demonstrate that the formation of negative hydrogen ions (H-) occurs in a wide class of atomic and molecular collisions. In our experiments, H- emission from hydroxyl cations and acetone molecules was observed in keV-energy collisions.…

Dissociative electron attachment (DEA) and ion-pair dissociation (IPD) processes of Difluoromethane (CH$_2$F$_2$) have been studied in the incident electron energy range 0 to 45 eV. Three different fragment anions (F$^-$, CHF$^-$ and…

Atomic and Molecular Clusters · Physics 2020-11-11 Dipayan Chakraborty , Dhananjay Nandi

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

Using a merged beams apparatus we have measured the associative detachment (AD) reaction of ${\rm H}^- + {\rm H} \to {\rm H}_2 + e^-$ for relative collision energies up to \textit{E}$_{\rm{r}} \leq 4.83$ eV. These data extend above the 1 eV…

Atomic Physics · Physics 2015-05-30 K. A. Miller , H. Bruhns , J. Eliášek , M. Čížek , H. Kreckel , X. Urbain , D. W. Savin

Unique polar properties of nanoscale hafnia-zirconia oxides (Hf$_x$Zr$_{1-x}$O$_2$) are of great interest for condensed matter physics, nanophysics and advanced applications. These properties are connected (at least partially) to the…

Materials Science · Physics 2025-01-22 Eugene A. Eliseev , Sergei V. Kalinin , Anna N. Morozovska

Long-range bound states of the excited heteronuclear 3He*--4He* system that dissociate to either 3He(1s2s 3S_1) + 4He(1s2p 3P_j) or 3He(1s2p 3P_j) + 4He(1s2s 3S_1), where j=0, 1, 2, are investigated using both single-channel and…

Atomic and Molecular Clusters · Physics 2015-05-04 Daniel G. Cocks , Gillian Peach , Ian B. Whittingham

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

The effect of the strong intersite Coulomb correlations on the formation of the electron structure of the t-V-model has been studied. A qualitatively new result has been obtained which consists in the occurrence of a split-off band of the…

Strongly Correlated Electrons · Physics 2009-11-06 Valery V. Val'kov , Maxim M. Korovushkin

Highly excited C$_2{}^{-}$ ions prominently feature electron detachment at a mean decay time near 3 milliseconds with hitherto unexplained origin. Considering various sources of unimolecular decay, we attribute the signal to the electronic…