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Quantum control of molecular collision dynamics is an exciting emerging area of cold collisions. Co-expansion of collision partners in a supersonic molecular beam combined with precise control of their quantum states and…

化学物理 · 物理学 2021-09-29 Pablo G. Jambrina , James F. E. Croft , Naduvalath Balakrishnan , F. Javier Aoiz

The results of accurate quantum reactive scattering calculations for the D + HD($v=4$, $j=0$) $\to$ D + HD($v'$, $j'$), D + HD($v=4$, $j=0$) $\to$ H + D$_2$($v'$, $j'$) and H + D$_2$($v=4$, $j=0$) $\to$ D + HD($v'$,$j'$) reactions are…

化学物理 · 物理学 2017-01-04 Brian K. Kendrick , Jisha Hazra , N. Balakrishnan

Collisions between hot hydrogen atoms and CO$_2$ play a central role in energy transfer and atmospheric escape in CO$_2$-rich planetary atmospheres. We present quantum mechanical $j_z$-conserving coupled-states calculations of…

地球与行星天体物理 · 物理学 2025-12-25 Cheikh T. Bop , Marko Gacesa

Chloronium (H$_2$Cl$^+$) is an important intermediate of Cl-chemistry in space. The accurate knowledge of its collisional properties allows a better interpretation of the corresponding observations in interstellar clouds and therefore a…

化学物理 · 物理学 2024-12-31 Sándor Demes , Dariusz Kędziera , Alexandre Faure , François Lique

Quantum scattering calculations are reported for the H+HCl(v,j=0) and H+DCl(v,j=0) collisions for vibrational levels v=0-2 of the diatoms. Calculations were performed for incident kinetic energies in the range 10-7 to 10-1 eV, for total…

化学物理 · 物理学 2009-11-10 P. F. Weck , N. Balakrishnan

A five-dimensional coupled states (5D-CS) approximation is used to compute cross sections and rate coefficients for CO+H2 collisions. The 5D-CS calculations are benchmarked against accurate six-dimensional close-coupling (6D-CC)…

天体物理仪器与方法 · 物理学 2017-01-20 Christina Castro , Kyle Doan , Michael Klemka , Robert C. Forrey , B. H. Yang , Phillip C. Stancil , N. Balakrishnan

We present quantum dynamics of collisions between two para-H2 molecules from low (1 mK) to high collision energies (1 eV). The calculations are carried out using a quantum scattering code that solves the time-independent Schrodinger…

化学物理 · 物理学 2009-03-18 Goulven Quéméner , Naduvalath Balakrishnan

Using time-resolved infrared-vacuum-ultraviolet double-resonance spectroscopy, experimental room temperature measurements of state-to-state rate coefficients for rotational energy transfer within the X $^1\Sigma^+(v=2)$ vibrational state of…

量子物理 · 物理学 2026-03-10 Hamza Labiad , Alexandre Faure , Ian R. Sims

Collision cross sections and rate constants between two ground- state oxygen molecules are investigated theoretically at translational energies below $\sim 1$K and in zero magnetic field. We present calculations for elastic and spin-…

原子物理 · 物理学 2009-11-07 Alexandr V. Avdeenkov , John L. Bohn

We present a treatment of cold hydrogen-antihydrogen collisions based on the asymptotic properties of atom-antiatom interactions. We derive general formulas for the elastic and inelastic cross sections and for the scattering lengths and…

原子物理 · 物理学 2009-11-13 A. Yu. Voronin , P. Froelich

We demonstrate rotational excitation of molecular ions that are sympathetically cooled by laser-cooled atomic ions to a temperature as low as ca. 10 mK. The molecular hydrogen ions HD+ and the fundamental rotational transition $(v=0,\,…

量子物理 · 物理学 2013-11-05 J. Shen , A. Borodin , M. Hansen , S. Schiller

We have calculated elastic and state-resolved inelastic cross sections for cold and ultracold collisions in the Rb($^1 S$) + OH($^2 \Pi_{3/2}$) system, including fine-structure and hyperfine effects. We have developed a new set of five…

原子物理 · 物理学 2015-06-26 Manuel Lara , John L. Bohn , Daniel E. Potter , Pavel Soldán , Jeremy M. Hutson

We have calculated quantum reactive and elastic cross-sections for D$^{+}+$ para-H$_2$($v$=0, $j$=0) $\rightarrow$ H$^+$ + HD collisons using the hyperspherical quantum reactive scattering method [Chem. Phys. Lett. 1990,169, 473]. The…

化学物理 · 物理学 2014-10-07 Manuel Lara , P. G. Jambrina , F. J. Aoiz , J. -M. Launay

Reactive and elastic cross-sections, and rate coefficients, have been calculated for the S(1D)+ D2 (v=0, j=0) reaction using a modified hyperspherical quantum reactive scattering method. The considered collision energy ranges from the…

化学物理 · 物理学 2023-05-24 Manuel Lara , P. G. Jambrina , F. J. Aoiz

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…

Scattering and ionizing cross sections and rates are calculated for ultracold collisions between metastable helium atoms using a fully quantum-mechanical close-coupled formalism. Homonuclear collisions of the bosonic ${}^{4}$He$^{*}…

原子物理 · 物理学 2019-07-03 D. G. Cocks , I. B. Whittingham , G. Peach

Radiative charge exchange collisions between a carbon atom C(${}^3$P) and a helium ion He+, both in their ground state, are investigated theoretically. Detailed quantum chemistry calculations are carried out to obtain potential energy…

原子物理 · 物理学 2017-01-25 James F. Babb , B. M. McLaughlin

Carbon monoxide is a simple molecule present in many astrophysical environments, and collisional excitation rate coefficients due to the dominant collision partners are necessary to accurately predict spectral line intensities and extract…

Quantum reactive scattering calculations for the hydrogen exchange reaction H + H$_2$($v=4$, $j=0$) $\to$ H + H$_2$($v'$, $j'$) and its isotopic analogues are reported for ultracold collision energies. Due to the unique properties…

化学物理 · 物理学 2015-10-14 Brian K. Kendrick , Jisha Hazra , Naduvalath Balakrishnan

Energy transfer between different mechanical degrees of freedom in atom-molecule collisions has been widely studied and largely understood. However, systems involving spins remain less explored, especially with a state-to-state precision.…