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We propose a new computational method for astrophysical reaction rate of radiative capture process. In the method, an evolution of a wave function is calculated along the imaginary-time axis which is identified as the inverse temperature.…

Nuclear Theory · Physics 2015-06-04 Kazuhiro Yabana , Yasuro Funaki

We use quantum and classical adiabatic capture theories to study the chemical reaction Li + CaH -> LiH + Ca. Using a recently developed ab initio potential energy surface, which provides an accurate representation of long-range interactions…

Atomic Physics · Physics 2015-06-23 Timur V. Tscherbul , Alexei A. Buchachenko

We propose an efficient method to compute reaction rate constants of thermally activated processes occurring in many-body systems at finite temperature. The method consists in two steps: first, paths are sampled using a transition path…

Statistical Mechanics · Physics 2011-12-22 Massimiliano Picciani

We investigate even-even two-proton borromean systems at prominent intermediate heavy waiting points for the rapid proton capture process. The most likely single-particle levels are used to calculate three-body energy and structure as a…

Nuclear Theory · Physics 2016-02-03 D. Hove , A. S. Jensen , H. O. U. Fynbo , N. T. Zinner , D. V. Fedorov , E. Garrido

Within the framework of the modified potential cluster model with a classification of orbital states according to Young diagrams, the possibility of prediction absentee experimental data for the total cross sections of the radiative neutron…

Nuclear Theory · Physics 2019-11-14 S. B. Dubovichenko , N. A. Burkova , A. V. Dzhazairov-Kakhramanov

Using imaginary-time theory, it is shown that the triple-alpha reaction rate can be reliably calculated without the need to solve scattering problems involving three charged particles. The calculated reaction rate is found to agree well…

Nuclear Theory · Physics 2015-08-26 T. Akahori , Y. Funaki , K. Yabana

We apply quantum rate theory to calculate the transition rates as hydrogen or deuterium atoms escape from a vacancy trap in iron into a neighbouring metastable site. We determine transition rates and corresponding activation energies over a…

Materials Science · Physics 2014-01-21 Ivaylo H. Katzarov , Anthony T. Paxton

Semiclassical instanton theory is a form of quantum transition-state theory which can be applied to computing thermal reaction rates for complex molecular systems including quantum tunneling effects. There have been a number of attempts to…

Chemical Physics · Physics 2020-10-28 Wei Fang , Pierre Winter , Jeremy O. Richardson

Instanton theory relates the rate constant for tunneling through a barrier to the periodic classical trajectory on the upturned potential energy surface whose period is $\tau=\hbar/(k_{\rm B}T)$. Unfortunately, the standard theory is only…

Chemical Physics · Physics 2024-11-14 Joseph E. Lawrence

We calculated reaction rate constants including atom tunneling of the reaction of dihydrogen with the hydroxy radical down to a temperature of 50 K. Instanton theory and canonical variational theory with microcanonical optimized…

Chemical Physics · Physics 2016-05-31 Jan Meisner , Johannes Kästner

The radiative neutron capture reaction rates have been studied at very low energies which are of interest for nuclear astrophysics. The rates for many of these reactions have remained independent of temperature so far. The temperature…

Nuclear Theory · Physics 2021-07-26 Vinay Singh , Joydev Lahiri , D. N. Basu

We present a general formalism for computing self-consistent, numerical solutions to the time-dependent radiative transfer equation in low velocity, multi-level ions undergoing radiative interactions. Recent studies of time-dependent…

High Energy Astrophysical Phenomena · Physics 2015-06-12 Matthew van Adelsberg , Rosalba Perna

The rovibrational electric dipole transitions in the ground electronic state of the HD molecule are studied. A simple, yet rigorous formula is derived for the transition rates in terms of the electric dipole moment function $D(R)$, which is…

Chemical Physics · Physics 2009-11-13 Krzysztof Pachucki , Jacek Komasa

We present here a formally exact model for electronic transitions between an initial (donor) and final (acceptor) states linked by an intermediate (bridge) state. Our model incorporates a common set of vibrational modes that are coupled to…

Materials Science · Physics 2016-03-28 E. R. Bittner

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

We investigate the low-temperature reaction rates for radiative capture processes of three particles. We compare direct and sequential capture mechanisms and rates using realistic phenomenological parametrizations of the corresponding…

Nuclear Theory · Physics 2015-05-30 E. Garrido , R. de Diego , D. V. Fedorov , A. S. Jensen

Reaction rate constants and cross sections are computed for the radiative association of carbon cations ($\text{C}^+$) and fluorine atoms ($\text{F}$) in their ground states. We consider reactions through the electronic transition $1^1\Pi…

Chemical Physics · Physics 2015-10-01 Jonatan Öström , Dmitry S. Bezrukov , Gunnar Nyman , Magnus Gustafsson

A relativistic transient absorption theory is derived, implemented and validated within the dipole approximation based on the time-dependent Dirac equation. Time-dependent simulations have been performed using the Dirac equation and the…

Atomic Physics · Physics 2020-10-14 Felipe Zapata , Jimmy Vinbladh , Eva Lindroth , Jan Marcus Dahlström

Within the framework of the modified potential cluster model with a classification of orbital states according to Young diagrams, the possibility of data description of the radiative neutron capture on 11B to the second excited state of 12B…

Nuclear Theory · Physics 2021-03-12 S. B. Dubovichenko , N. A. Burkova , A. V. Dzhazairov-Kakhramanov

The transition rate for a two-state system interacting with a bosonic heat bath, from the initial state `up' at time t=0 to `down' at time t>0, was derived formally in the seminal paper [12] by Leggett, Chakravarty, Dorsey, Fisher, Garg and…

Mathematical Physics · Physics 2012-12-11 Marco Merkli , Haifeng Song
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