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A practical method for finding free energy barriers for transitions in high-dimensional classical and quantum systems is presented and used to calculate the dissociative sticking probability of H2 on a metal surface within transition state…

chem-ph · Physics 2009-10-22 Gregory Mills , Hannes Jonsson

We present theoretical thermally-averaged rate constants for vibrational and rotational (de-)excitation of the H3+ ion by electron impact. The constants are calculated using the multi-channel quantum-defect approach. The calculation…

Atomic Physics · Physics 2015-05-18 Viatcheslav Kokoouline , Alexandre Faure , Jonathan Tennyson , Chris H. Greene

We use a form of the fluctuation-dissipation theorem to derive formulas giving the rate of production of spin-1/2 baryons in terms of the fluctuations of either meson or quark fields. The most general formulas do not assume thermal or…

Nuclear Theory · Physics 2009-11-07 Joseph Kapusta , Igor Shovkovy

Cross section of the neutron capture reaction $n+p\rightarrow d+\gamma$ at threshold was calculated with different realistic $^{3}S_{1}$ deuteron and $^{1}S_{0}$ $np$ scattering wave functions stemming from Nijmegen-II, JISP16, Paris, Idaho…

Nuclear Theory · Physics 2017-06-22 N. A. Khokhlov

The time evolution of the thermally activated decay rates is considered. This evolution is of particular importance for the recent nanoscale experiments discussed in the literature, where the potential barrier is relatively low (or the…

Statistical Mechanics · Physics 2021-04-21 Maria Chushnyakova , Igor Gontchar , Natalya Khmyrova

For a detailed understanding of chemical processes in nature and industry, we need accurate models of chemical reactions in complex environments. While Eyring transition state theory is commonly used for modeling chemical reactions, it is…

Chemical Physics · Physics 2023-12-19 Simon Ghysbrecht , Bettina G. Keller

We present an analytic formulation to model the fluctuating component of the HI signal from the epoch of reionization during the phase of partial heating. During this phase, we assume self-ionized regions, whose size distribution can be…

Cosmology and Nongalactic Astrophysics · Physics 2018-06-14 Janakee Raste , Shiv Sethi

The reaction between D$^+$ and H$_2$ plays an important role in astrochemistry at low temperatures and also serves as a prototype for simple ion-molecule reaction. Its ground $\tilde{X}~^1A^{\prime}$ state has a very small thermodynamic…

Chemical Physics · Physics 2018-11-14 Somnath Bhowmick , Duncan Bossion , Yohann Scribano , Yury V. Suleimanov

The final step of the water formation network on interstellar grain surfaces starting from the H + O$_2$ route is the reaction between H and H$_2$O$_2$. This reaction is known to have a high activation energy and therefore at low…

Chemical Physics · Physics 2016-12-01 Thanja Lamberts , Pradipta Kumar Samanta , Andreas Köhn , Johannes Kästner

We present a theory of resonant processes in a frozen gas of atoms interacting via dipole-dipole potentials that vary as $r^{-3}$, where $r$ is the interatomic separation. We supply an exact result for a single atom in a given state…

Disordered Systems and Neural Networks · Physics 2009-10-31 J. S. Frasier , V. Celli , T. Blum

There are several inequivalent proposals in the literature for how to compute the probability distribution of the time that a detector registers for the arrival of a quantum particle. For two of these proposals, based on absorbing boundary…

Quantum Physics · Physics 2026-03-24 Alireza Jozani , Roderich Tumulka

Jump rates of muonium and hydrogen in diamond are calculated by quantum transition-state theory, based on the path-integral centroid formalism. This technique allows us to study the influence of vibrational mode quantization on the…

Materials Science · Physics 2009-11-13 Carlos P. Herrero , Rafael Ramirez

A method for evaluating the radial temperature profile of a plasma channel is presented. The radiation spectrum of mixture of Hydrogen Nitrogen plasma in capillary discharge is collected. Assuming a local thermal equilibrium, the…

Plasma Physics · Physics 2024-01-30 Niv Barkai , Noa kliss , Yair Ferber , Yoav Raz , Rotem Liran , Mordechai Botton , Arie Zigler

We investigate whether making the friction spatially dependent on the reaction coordinate introduces quantum effects into the thermal reaction rates for dissipative reactions. Quantum rates are calculated using the numerically exact…

The $\pi^- + {^2{\rm H}} \rightarrow \gamma + n + n$, $\pi^- + {^3{\rm He}} \rightarrow \gamma + {^3{\rm H}}$, $\pi^- + {^3{\rm He}} \rightarrow \gamma + n + d$, $\pi^- + {^3{\rm He}} \rightarrow \gamma + n + n + p$ and $\pi^- + {^3{\rm H}}…

Nuclear Theory · Physics 2018-11-14 J. Golak , R. Skibinski , K. Topolnicki , H. Witala , A. Grassi , H. Kamada , A. Nogga , L. E. Marcucci

A diathermal wall between two heat baths at different temperatures can be mimicked by a layer of independent spin pairs with some internal energy and where each spin $\sigma_a$ is flipped by thermostat $a$ ($a=1,2$). The transition rates…

Statistical Mechanics · Physics 2015-05-06 Françoise Cornu , Michel Bauer

We calculate the rate of the spontaneous magnetic dipole radiation transitions from ortho- to para-states of the hydrogen molecule at the room temperature with the radiation wavelengths about 0.01 - 0.1 cm. Exponentially small differences…

Atomic Physics · Physics 2018-11-19 A. M. Ishkhanyan , V. P. Krainov

Measured hadron yields from relativistic nuclear collisions can be equally well understood in two physically distinct models, namely a static thermal hadronic source vs.~a time-dependent, nonequilibrium hadronization off a quark-gluon…

Nuclear Theory · Physics 2011-09-13 C. Spieles , H. Stoecker , C. Greiner

We study an excited atom-polar molecular ion chemical reaction (Ca$^*$ + BaCl$^+$) at low temperature by utilizing a hybrid atom-ion trapping system. The reaction rate and product branching fractions are measured and compared to model…

Experimental measurements and theoretical calculations of state-to-state rate coefficients for rotational energy transfer of CO in collision with H$_2$ are reported at the very low temperatures prevailing in dense interstellar clouds (5 -…