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1.
J Chem Phys ; 156(14): 144308, 2022 Apr 14.
Artigo em Inglês | MEDLINE | ID: mdl-35428379

RESUMO

The rotationally resolved infrared (IR) spectrum of the He-H3 + complex has been measured in a cryogenic ion trap experiment at a nominal temperature of 4 K. Predissociation of the stored complex has been invoked by excitation of the degenerate ν2 mode of the H3 + sub-unit using a pulsed optical parametric oscillator system. An assignment of the experimental spectrum became possible through one-to-one correlations with bands of the spectrum theoretically predicted in Paper I [Harding et al., J. Chem. Phys. 156, 144307 (2022)]. 19 bands have been assigned and analyzed, and the energy term diagram of the lower states of this floppy molecular complex has been derived from combination differences (CDs) in the experimental spectrum. Ground state combination differences (GSCDs) reveal a large part of the energy term diagram for the He-H3 + complex in its vibrational ground state, v = 0. Experimental and theoretical term energies agree within experimental accuracy for the rotational fine structure associated with the total angular momentum quantum number J and the parity e/f as well as for the coarse spacing of the lowest K states of the complex. This favorable comparison shows that the potential energy surface (PES) calculated in Paper I is accurate. The barriers between the three equivalent global minima in this PES are relatively low and the He-H3 + complex is extremely floppy, with nearly unhindered internal rotation of the H3 + sub-unit. The resulting Coriolis interactions couple the internal and end-over-end rotation of the complex and contribute significantly to the energy terms. They are observed both in experiment and theory and are, e.g., the origin of different rotational constants for states of e and f parity. Also in this respect, experiment and theory agree very well. Despite the assignment and analysis of many bands of the extremely rich IR spectrum of He-H3 +, higher levels of excitation, including the complex stretching mode, need further attention.

2.
Chemphyschem ; 21(13): 1429-1435, 2020 Jul 02.
Artigo em Inglês | MEDLINE | ID: mdl-32394630

RESUMO

In order to study collisions between ions and neutrals, a new Guided Ion Beam (GIB) apparatus, called NOVion, has been assembled and tested. The primary purpose of this instrument is to measure absolute cross sections at energies relevant for technical or inter- and circumstellar plasmas. New and improved results are presented for forming H3 + in collisions of H2 + with H2 . Between 0.1 eV and 2 eV, our measured effective cross sections are in good overall agreement with most previous measurements. However, at higher energies, our results do not show the steep decline, recommended in the standard literature. After critical evaluation of all experimental and theoretical data, a new analytical function is proposed, describing properly the dependence of the title reaction on the collision energy up to 10 eV.

3.
J Hum Kinet ; 66: 19-29, 2019 Mar.
Artigo em Inglês | MEDLINE | ID: mdl-30988837

RESUMO

The aim of the research was to provide an analytical expression for the final time and velocity at the 100 m run, taking into account realistic conditions of the run, more precisely the effect of the wind and resistance of the medium (air). Combining the polynomial model for the distance vs time with the solution of the algebraic cubic equation, such an analytical expression was derived. The expression allowed to evaluate the dependence of the final time of the race on the wind velocity. This enabled the quantification of the time effect of the mentioned influences on the final time and velocity. It is possible to calculate the dependence of the sprinter's velocity on expired running time for various wind velocities (from 0 up to ± 10 m/s) as well as determine the maximal running velocity vmax and corresponding time moment tmax. The results obtained were verified using split time data for six top sprinters: C. Lewis, M. Green, U. Bolt and F. Griffith-Joyner, E. Ashford and H. Drechsler. The results confirmed that it was possible to quantify the time effect of the influence of the wind velocity and resistance of the medium on the final time of the 100 m run. Although the applicability of the approach was tested using the data concerning top sprinters, the mathematical expressions involved are simple enough to be used by any coach to estimate the results of a sprinter under various weather conditions.

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