Positron scattering from the cyclic ethers oxirane, 1,4-dioxane, and tetrahydropyran


Autoria(s): Zecca, A.; Trainotti, E.; Chiari, L.; Bettega, M. H. F.; Sanchez, S. d'A; Varella, Marcio Teixeira do Nascimento; Lima, M. A. P.; Brunger, M. J.
Contribuinte(s)

UNIVERSIDADE DE SÃO PAULO

Data(s)

21/10/2013

21/10/2013

2012

Resumo

In this paper we report original measurements of total cross sections (TCSs) for positron scattering from the cyclic ethers oxirane (C2H4O), 1,4-dioxane (C4H8O2), and tetrahydropyran (C5H10O). The present experiments focus on the low energy range from similar to 0.2 to 50 eV, with an energy resolution smaller than 300 meV. This study concludes our systematic investigation into TCSs for a class of organic compounds that can be thought of as sub-units or moieties to the nucleotides in living matter, and which as a consequence have become topical for scientists seeking to simulate particle tracks in matter. Note that as TCSs specify the mean free path between collisions in such simulations, they have enjoyed something of a recent renaissance in interest because of that application. For oxirane, we also report original Schwinger multichannel elastic integral cross section (ICS) calculations at the static and static plus polarisation levels, and with and without Born-closure that attempts to account for the permanent dipole moment of C2H4O. Those elastic ICSs are computed for the energy range 0.5-10 eV. To the best of our knowledge, there are no other experimental results or theoretical calculations against which we can compare the present positron TCSs. However, electron TCSs for oxirane (also known as ethylene oxide) and tetrahydropyran do currently exist in the literature and a comparison to them for each species will be presented. (C) 2012 American Institute of Physics. [http://dx.doi.org/10.1063/1.3696378]

University of Trento

University of Trento

Flinders University node of the ARC Centre of Excellence for AntimatterMatter Studies

Flinders University node of the ARC Centre of Excellence for Antimatter-Matter Studies

CAMS

CAMS

Brazilian agency Conselho Nacional de Desenvolvimento Cientifico e Tecnologico (CNPq)

Brazilian agency CNPq (Conselho Nacional de Desenvolvimento Cientifico e Tecnologico)

FINEP

FINEP

FAPESP

FAPESP

Identificador

JOURNAL OF CHEMICAL PHYSICS, MELVILLE, v. 136, n. 12, supl. 1, Part 2, pp. 2716-2727, 46813, 2012

0021-9606

http://www.producao.usp.br/handle/BDPI/35226

10.1063/1.3696378

http://dx.doi.org/10.1063/1.3696378

Idioma(s)

eng

Publicador

AMER INST PHYSICS

MELVILLE

Relação

JOURNAL OF CHEMICAL PHYSICS

Direitos

restrictedAccess

Copyright AMER INST PHYSICS

Palavras-Chave #SCHWINGER MULTICHANNEL METHOD #IONIZATION POTENTIALS #MOLECULES #ELECTRONS #ANNIHILATION #ORBITALS #METHANE #STATES #WATER #PHYSICS, ATOMIC, MOLECULAR & CHEMICAL
Tipo

article

original article

publishedVersion