Angle resolved electron energy loss spectra (EELS) for para-benzoquinone (C6H4O2) have been recorded for incident electron energies of 20, 30, and 40 eV. Measured differential cross sections (DCSs) for electronic band features, composed of a combination of energetically unresolved electronic states, are subsequently derived from those EELS. Where possible, the obtained DCSs are compared with those calculated using the Schwinger multichannel method with pseudopotentials. These calculations were performed using a minimum orbital basis single configuration interaction framework at the static exchange plus polarisation level. Here, quite reasonable agreement between the experimental cross sections and the theoretical cross sections for the summation of unresolved states was observed.
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28 March 2018
Research Article|
March 27 2018
Electron-impact electronic-state excitation of para-benzoquinone
D. B. Jones
;
D. B. Jones
a)
1
College of Science and Engineering, Flinders University
, GPO Box 2100, Adelaide, SA 5001, Australia
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R. F. da Costa;
R. F. da Costa
2
Instituto de Física “Gleb Wataghin,” Universidade Estadual de Campinas
, 13083-859 Campinas, São Paulo, Brazil
3
Centro de Ciências Exatas, Departamento de Física, Universidade Federal do Espírito Santo
, 29075-910 Vitória, Espírito Santo, Brazil
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F. Kossoski
;
F. Kossoski
2
Instituto de Física “Gleb Wataghin,” Universidade Estadual de Campinas
, 13083-859 Campinas, São Paulo, Brazil
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M. T. do N. Varella
;
M. T. do N. Varella
4
Instituto de Física, Universidade de São Paulo
, Rua do Matão 1731, 05508-090 São Paulo, São Paulo, Brazil
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M. H. F. Bettega
;
M. H. F. Bettega
5
Departamento de Física, Universidade Federal do Paraná
, CP 19044, 81531-990 Curitiba, Paraná, Brazil
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F. Ferreira da Silva;
F. Ferreira da Silva
6
Laboratório de Colisões Atómicas e Moleculares, CEFITEC, Departamento de Física, Faculdade de Ciências e Tecnologia, Universidade NOVA de Lisboa
, 2829-516 Caparica, Portugal
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P. Limão-Vieira
;
P. Limão-Vieira
6
Laboratório de Colisões Atómicas e Moleculares, CEFITEC, Departamento de Física, Faculdade de Ciências e Tecnologia, Universidade NOVA de Lisboa
, 2829-516 Caparica, Portugal
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G. García;
G. García
7
Instituto de Fisica Fundamental, CSIC
, Serrano 113-bis, E-28006 Madrid, Spain
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M. A. P. Lima
;
M. A. P. Lima
a)
2
Instituto de Física “Gleb Wataghin,” Universidade Estadual de Campinas
, 13083-859 Campinas, São Paulo, Brazil
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R. D. White;
R. D. White
8
College of Science and Engineering, James Cook University
, Townsville, Australia
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M. J. Brunger
M. J. Brunger
1
College of Science and Engineering, Flinders University
, GPO Box 2100, Adelaide, SA 5001, Australia
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D. B. Jones
1,a)
R. F. da Costa
2,3
F. Kossoski
2
M. T. do N. Varella
4
M. H. F. Bettega
5
F. Ferreira da Silva
6
P. Limão-Vieira
6
G. García
7
M. A. P. Lima
2,a)
R. D. White
8
M. J. Brunger
1
1
College of Science and Engineering, Flinders University
, GPO Box 2100, Adelaide, SA 5001, Australia
2
Instituto de Física “Gleb Wataghin,” Universidade Estadual de Campinas
, 13083-859 Campinas, São Paulo, Brazil
3
Centro de Ciências Exatas, Departamento de Física, Universidade Federal do Espírito Santo
, 29075-910 Vitória, Espírito Santo, Brazil
4
Instituto de Física, Universidade de São Paulo
, Rua do Matão 1731, 05508-090 São Paulo, São Paulo, Brazil
5
Departamento de Física, Universidade Federal do Paraná
, CP 19044, 81531-990 Curitiba, Paraná, Brazil
6
Laboratório de Colisões Atómicas e Moleculares, CEFITEC, Departamento de Física, Faculdade de Ciências e Tecnologia, Universidade NOVA de Lisboa
, 2829-516 Caparica, Portugal
7
Instituto de Fisica Fundamental, CSIC
, Serrano 113-bis, E-28006 Madrid, Spain
8
College of Science and Engineering, James Cook University
, Townsville, Australia
a)
Authors to whom correspondence should be addressed: [email protected] and [email protected]
J. Chem. Phys. 148, 124312 (2018)
Article history
Received:
January 24 2018
Accepted:
March 08 2018
Citation
D. B. Jones, R. F. da Costa, F. Kossoski, M. T. do N. Varella, M. H. F. Bettega, F. Ferreira da Silva, P. Limão-Vieira, G. García, M. A. P. Lima, R. D. White, M. J. Brunger; Electron-impact electronic-state excitation of para-benzoquinone. J. Chem. Phys. 28 March 2018; 148 (12): 124312. https://doi.org/10.1063/1.5023494
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