Currently browsing: Items authored or edited by Jimena Gorfinkiel https://orcid.org/0000-0001-9264-3932

70 items in this list.
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2024To Top

Houfek, Karel; Benda, Jakub; Mašín, Zdeněk; Harvey, Alex; Meltzer, Thomas; Graves, Vincent and Gorfinkiel, Jimena D. (2024). UKRmol-scripts: A Perl-based system for the automated operation of the photoionization and electron/positron scattering suite UKRmol+. Computer Physics Communications, 298, article no. 109113.

Graves, Vincent; Šenk, Jan; Kolorenč, Přemysl; Sisourat, Nicolas and Gorfinkiel, Jimena D. (2024). Virtual photon exchange vs electron transfer in interparticle Coulombic electron capture. The Journal of Chemical Physics, 160(20), article no. 204306.

Rajak, Debobrata; Beauvarlet, Sandra; Kneller, Omer; Comby, Antoine; Cireasa, Raluca; Descamps, Dominique; Fabre, Baptiste; Gorfinkiel, Jimena D.; Higuet, Julien; Petit, Stéphane; Rozen, Shaked; Ruf, Hartmut; Thiré, Nicolas; Blanchet, Valérie; Dudovich, Nirit; Pons, Bernard and Mairesse, Yann (2024). Laser-Induced Electron Diffraction in Chiral Molecules. Physical Review X, 14(1), article no. 011015.

Gorfinkiel, Jimena D and García, Fernando Martín (eds.) (2024). Attosecond Chemistry Special Issue. Computer Physics Communications, Volume 299, June 2024.

Bingham, Peter and Gorfinkiel, Jimena (2024). Resonances in electron scattering from H2 around the H(2l) + H−(1s2) dissociation limit. Journal of Physics B: Atomic, Molecular and Optical Physics, 57, article no. 105202.

2023To Top

Benito‐Gómez, Ignacio; Méndez, Luis; Suárez, Jaime; Gorfinkiel, Jimena D. and Rabadán, Ismanuel (2023). Resonant Fragmentation of the Water Cation by Electron Impact: a Wave‐Packet Study. ChemPhysChem, 24(19), article no. .202300305.

Benito‐Gómez, Ignacio; Méndez, Luis; Suárez, Jaime; Gorfinkiel, Jimena D. and Rabadán, Ismanuel (2023). Cover Feature: Resonant Fragmentation of the Water Cation by Electron Impact: a Wave‐Packet Study (ChemPhysChem 19/2023). ChemPhysChem, 24(19)

2022To Top

Celiberto, Roberto; Gorfinkiel, Jimena D.; Laricchiuta, Annarita and Tennyson, Jonathan (2022). Methods for electron–molecule scattering. In: Colonna, Gianpiero and D'Angola, Antonio eds. Plasma Modeling: Methods and Applications (Second Edition). IOP, 22:1-22:38.

Benda, J.; Mašín, Z. and Gorfinkiel, J. D. (2022). Analysis of RABITT time delays using the stationary multiphoton molecular R -matrix approach. Physical Review A, 105(5)

Graves, Vincent and Gorfinkiel, Jimena D. (2022). R-matrix calculations for elastic electron and positron scattering from pyrazine: effect of the polarization description. The European Physical Journal D, 76(3), article no. 43.

2021To Top

Edwards, D.; Stevens, D.; Cheong, Z.; Graves, V.; Gorfinkiel, J. D.; Blanco, F.; Garcia, G.; Brunger, M. J.; White, R. D. and Sullivan, J. P. (2021). Positron scattering from pyrazine. Physical Review A, 104(4), article no. 042807.

Molle, Axel; Dubois, Alain; Gorfinkiel, Jimena D.; Cederbaum, Lorenz S. and Sisourat, Nicolas (2021). Electron attachment to a proton in water by interatomic Coulombic electron capture: An R-matrix study. Physical Review A, 104(2), article no. 022818.

Rabadán, I. and Gorfinkiel, J. D. (2021). Toward a description of electron-induced dissociative excitation in H$_2$O$^+$ : Investigation of three resonances above the B̃ state. Physical Review A, 103(3), article no. 032804.

Molle, Axel; Dubois, Alain; Gorfinkiel, Jimena; Cederbaum, Lorenz S. and Sisourat, Nicolas (2021). Fano interferences in environment-enabled electron capture. Physical Review A, 103(1), article no. 012808.

García-Abenza, Adrián; Lozano, Ana I.; Oller, Juan C.; Blanco, Francisco; Gorfinkiel, Jimena D.; Limão-Vieira, Paulo and García, Gustavo (2021). Evaluation of Recommended Cross Sections for the Simulation of Electron Tracks in Water. Atoms, 9(4), article no. 98.

2020To Top

Schneider, Barry I.; Bartschat, Klaus; Zatsarinny, Oleg; Hamilton, Kathryn R.; Bray, Igor; Scrinzi, Armin; Martin, Fernando; Gonzalez Vasquez, Jesus; Tennyson, Jonathan; Gorfinkiel, Jimena D.; Lucchesse, Robert and Pamidighantam, Sudhakar (2020). Atomic and Molecular Scattering Applications in an Apache Airavata Science Gateway. In: Practice and Experience in Advanced Research Computing, ACM pp. 270–277.

Brown, Andrew C.; Armstrong, Gregory S.J.; Benda, Jakub; Clarke, Daniel D.A.; Wragg, Jack; Hamilton, Kathryn R.; Mašin, Zdeněk; Gorfinkiel, Jimena D. and van der Hart, Hugo W. (2020). RMT: R-matrix with time-dependence. Solving the semi-relativistic, time-dependent Schrödinger equation for general, multi-electron atoms and molecules in intense, ultrashort, arbitrarily polarized laser pulses. Computer Physics Communications, 250, article no. 107062.

Sukuba, Ivan and Gorfinkiel, Jimena D. (2020). Electron collisions with BeH2 below 20 eV. Physical Review A, 101(5), article no. 052709.

Mašin, Zdeněk; Benda, Jakub; Gorfinkiel, Jimena D.; Harvey, Alex G. and Tennyson, Jonathan (2020). UKRmol+: A suite for modelling electronic processes in molecules interacting with electrons, positrons and photons using the R-matrix method. Computer Physics Communications, 249, article no. 107092.

Wragg, J.; Benda, J.; Mašin, Z.; Armstrong, G.S.J.; Clarke, D.D.A.; Brown, A.C.; Ballance, C.; Harvey, A.G.; Houfek, K.; Sunderland, A.; Plummer, M.; Gorfinkiel, J.D. and van der Hart, H. (2020). Atomic and molecular suite of R-matrix codes for ultrafast dynamics in strong laser fields and electron/positron scattering. Journal of Physics: Conference Series, 1412(7), article no. 072017.

Benda, J.; Mašin, Z.; Armstrong, G.S.J.; Clarke, D.D.A.; Brown, A.C.; Gorfinkiel, J.D. and van der Hart, H. (2020). Photoionization of H2 using the molecular R-matrix with time approach. Journal of Physics: Conference Series, 1412(15), article no. 152066.

Gorfinkiel, Jimena (2020). Electron Collisions with Molecules and Molecular Clusters. European Journal of Physics D, 74, article no. 51.

Gorfinkiel, Jimena D. (2020). Resonances in molecules and molecular clusters. Journal of Physics: Conference Series, 1412, article no. 052003.

Costa, Filipe; Traoré-Dubuis, Ali; Álvarez, Lidia; Lozano, Ana I.; Ren, Xueguang; Dorn, Alexander; Limão-Vieira, Paulo; Blanco, Francisco; Oller, Juan C.; Muñoz, Antonio; García-Abenza, Adrián; Gorfinkiel, Jimena D.; Barbosa, Alessandra S.; Bettega, Marcio H. F.; Stokes, Peter; White, Ronald D.; Jones, Darryl B.; Brunger, Michael J. and García, Gustavo (2020). A Complete Cross Section Data Set for Electron Scattering by Pyridine: Modelling Electron Transport in the Energy Range 0–100 eV. International Journal of Molecular Sciences, 21(18), article no. 6947.

Benda, Jakub; Gorfinkiel, Jimena; Mašin, Zdeněk; Armstrong, G. S. J.; Brown, A. C.; Clarke, D. D. A.; van der Hart, H. W. and Wragg, J. (2020). Perturbative and nonperturbative photoionization of H2 and H2O using the molecular ℝ-matrix-with-time method. Physical Review A, 102(5), article no. 052826.

2019To Top

Cooper, Bridgette; Tudorovskaya, Maria; Mohr, Sebastian; O’Hare, Aran; Hanicinec, Martin; Dzarasova, Anna; Gorfinkiel, Jimena; Benda, Jakub; Mašín, Zdeněk; Al-Refaie, Ahmed F.; Knowles, Peter J. and Tennyson, Jonathan (2019). Quantemol Electron Collisions (QEC): An Enhanced Expert System for Performing Electron Molecule Collision Calculations Using the R-Matrix Method. Atoms, 7(4), article no. 97.

Bingham, Peter S. and Gorfinkiel, Jimena D. (2019). reskit: a toolkit to determine the poles of an S-matrix. Computer Physics Communications, 239 pp. 272–282.

Loupas, Alexandra and Gorfinkiel, Jimena D. (2019). Shape and core-excited resonances in electron scattering from alanine. The Journal of Chemical Physics, 150(6), article no. 064307.

2018To Top

Sisourat, Nicolas; Miteva, Tsveta; Gorfinkiel, Jimena D.; Gokhberg, Kirill and Cederbaum, Lorenz S. (2018). Interatomic Coulombic electron capture from first principles. Physical Review A, 98(2), article no. 020701(R).

Loupas, Alexandra; Lozano, Ana. I.; Blanco, Francisco; Gorfinkiel, Jimena D. and García, Gustavo (2018). Cross sections for electron scattering from thiophene for a broad energy range. The Journal of Chemical Physics, 149(3), article no. 034304.

Loupas, Alexandra; Regeta, Khrystyna; Allan, Michael and Gorfinkiel, Jimena D. (2018). Shape and Core-Excited Resonances in Thiophene. The Journal of Physical Chemistry A, 122(4) pp. 1146–1155.

Lozano, A. I.; Loupas, A.; Blanco, F.; Gorfinkiel, J. D. and García, G. (2018). Total electron scattering cross sections from thiophene for the (1-300 eV) impact energy range. The Journal of Chemical Physics, 149(13), article no. 134303.

2017To Top

Sieradzka, Agnieszka and Gorfinkiel, Jimena D. (2017). Theoretical study of resonance formation in microhydrated molecules. II. Thymine-(H2O)n, n = 1,2,3,5. The Journal of Chemical Physics, 147(3), article no. 034303.

Sieradzka, Agnieszka and Gorfinkiel, Jimena D. (2017). Theoretical study of resonance formation in microhydrated molecules. I. Pyridine-(H2O)n, n = 1,2,3,5. Journal of Chemical Physics, 147(3), article no. 034302.

Sisourat, Nicolas; Engin, Selma; Gorfinkiel, Jimena D.; Kazandjian, Sévan; Kolorenč, Přemysl and Miteva, Tsveta (2017). On the computations of interatomic Coulombic decay widths with R-matrix method. The Journal of Chemical Physics, 146(24), article no. 244109.

Loupas, Alexandra and Gorfinkiel, Jimena D. (2017). Resonances in low-energy electron scattering from para-benzoquinone. Physical Chemistry Chemical Physics, 19(28) pp. 18252–18261.

Gorfinkiel, Jimena D. and Ptasinska, Sylwia (2017). Electron scattering from molecules and molecular aggregates of biological relevance. Journal of Physics B: Atomic, Molecular and Optical Physics, 50(18) p. 182001.

2016To Top

Mašin, Zdeněk and Gorfinkiel, Jimena D. (2016). Effect of the third π∗ resonance on the angular distributions for electron-pyrimidine scattering. The European Physical Journal D, 70(7), article no. 151.

Allan, Michael; Regeta, Khrystyna; Gorfinkiel, Jimena D.; Mašin, Zdeněk; Grimme, Stefan and Bannwarth, Christoph (2016). Recent research directions in Fribourg: nuclear dynamics in resonances revealed by 2-dimensional EEL spectra, electron collisions with ionic liquids and electronic excitation of pyrimidine. The European Physical Journal D, 70(5), article no. 123.

Regeta, Khrystyna; Allan, Michael; Mašin, Zdeněk and Gorfinkiel, Jimena D. (2016). Absolute cross sections for electronic excitation of pyrimidine by electron impact. Journal of Chemical Physics, 144(2), article no. 024302.

Regeta, Khrystyna; Allan, Michael; Winstead, Carl; McKoy, Vincent; Mašin, Zdeněk and Gorfinkiel, Jimena D. (2016). Resonance effects in elastic cross sections for electron scattering on pyrimidine: Experiment and theory. Journal of Chemical Physics, 144(2), article no. 024301.

2015To Top

Brambila, Danilo S; Harvey, Alex G; Mašin, Zdeněk; Gorfinkiel, Jimena D. and Smirnova, Olga (2015). The role of multichannel effects in the photoionization of the NO2 molecule: an ab initio R- matrix study. Journal of Physics B: Atomic, Molecular and Optical Physics, 48(24), article no. 245101.

2014To Top

Sieradzka, A.; Blanco, F.; Fuss, M. C.; Mašin, Z.; Gorfinkiel, J. D. and García, G. (2014). Electron scattering from pyridine. Journal of Physical Chemistry A, 118(33) pp. 6657–6663.

Mašin, Zdeněk and Gorfinkiel, Jimena D. (2014). Resonance formation in low energy electron scattering from uracil. European Physical Journal D, 68(5), article no. 112.

Mašin, Zdeněk and Gorfinkiel, Jimena D. (2014). Towards an accurate representation of the continuum in calculations of electron, positron and laser field interactions with molecules. Journal of Physics: Conference Series, 490(1), article no. 012090.

Sanz, A. G.; Fuss, M. C.; Blanco, F.; Mašin, Zdeněk; Gorfinkiel, Jimena D.; Carelli, F.; Sebastianelli, F.; Gianturco, F. A. and García, G. (2014). Electron scattering cross section calculations for polar molecules over a broad energy range. Applied Radiation and Isotopes, 83(B) pp. 57–67.

Brunger, M. J.; Buckman, S. J.; Palihawadana, P.; Jones, D. B.; Chiari, L.; Pettifer, Z.; da Silva, G. B.; Lopes, M. C. A.; Duque, H. V.; Mašin, Z.; Gorfinkiel, J. D.; Garcia, G.; Hoshino, M.; Tanaka, H. and Limão-Vieira, P. (2014). Recent progress in electron scattering from atoms and molecules. AIP Conference Proceedings, 1588, article no. 71.

2013To Top

Sanz, A. G.; Fuss, M. C.; Blanco, F.; Mašin, Z.; Gorfinkiel, J. D.; McEachran, R. P.; Brunger, M. J. and García, G. (2013). Cross-section calculations for positron scattering from pyrimidine over an energy range from 0.1 to 10000 eV. Physical Review A, 88(6), article no. 062704.

Sanz, A. G.; Fuss, M. C.; Blanco, F.; Gorfinkiel, J. D.; Almeida, D.; Ferreira da Silva, F.; Limão-Vieira, P.; Brunger, M. J. and García, G. (2013). An investigation into electron scattering from pyrazine at intermediate and high energies. Journal of Chemical Physics, 139, article no. 184310.

Palihawadana, P.; Sullivan, J. P.; Buckman, S. J.; Mašin, Z.; Gorfinkiel, J. D.; Blanco, F.; García, G. and Brunger, M. J. (2013). A joint theoretical and experimental study for elastic electron scattering from 1,4-dioxane. Journal of Chemical Physics, 139(1)

2012To Top

Mašin, Zdeněk and Gorfinkiel, Jimena D. (2012). Shape and core excited resonances in electron collisions with diazines. Journal of Chemical Physics, 137(20), article no. 204312.

Mašin, Zdeněk; Gorfinkiel, Jimena; Jones, Darryl B.; Bellm, Susan M. and Brunger, Michael J. (2012). Elastic and inelastic cross sections for low-energy electron collisions with pyrimidine. Journal of Chemical Physics, 136(14), article no. 144310.

Gorfinkiel, Jimena D. and Caprasecca, Stefano (2012). A multiple-scattering approach to electron collisions with small molecular clusters. In: Garcia Gomez-Tejedor, Gustavo and Fuss, Martina Christina eds. Radiation Damage in Biomolecular Systems. Biological and Medical Physics, Biomedical Engineering. Springer Science+Business Media, pp. 127–142.

Carr, J. M.; Galiatsatos, P. G.; Gorfinkiel, J. D.; Harvey, A. G.; Lysaght, M. A.; Madden, D.; Mašin, Z.; Plummer, M.; Tennyson, J. and Varambhia, H. N. (2012). UKRmol: a low-energy electron- and positron-molecule scattering suite. The European Physical Journal D, 66(3), article no. 58.

Fabrikant, I. I.; Caprasecca, S.; Gallup, G. A. and Gorfinkiel, J. D. (2012). Electron attachment to molecules in a cluster environment. The Journal of Chemical Physics, 136(18), article no. 184301.

2011To Top

Mašin, Zdeněk and Gorfinkiel, Jimena (2011). Elastic and inelastic low-energy electron collisions with pyrazine. The Journal of Chemical Physics, 135(14) pp. 144308–144321.

2009To Top

Caprasecca, S; Gorfinkiel, J.; Bouchiha, D. and Caron, L. G. (2009). Multiple scattering approach to elastic electron collisions with molecular clusters. Journal of Physics B: Atomic, Molecular and Optical Physics, 42(9) 095205.

2008To Top

Halmov'a, Gabriela; Gorfinkiel, J. D. and Tennyson, J. (2008). Low and intermediate energy electron collisions with the C−2 molecular anion. Journal of Physics B: Atomic, Molecular and Optical Physics, 41(15) p. 155201.

Bouchiha, D.; Caron, L. G.; Gorfinkiel, J. D. and Sanche, L. (2008). Multiple scattering approach to elastic low-energy electron collisions with the water dimer. Journal of Physics B: Atomic, Molecular and Optical Physics, 41(4) 045204.

Muñoz, A; Oiler, J. C.; Blanco, F.; Gorfinkiel, J. D.; Limão-Vieira, P.; Maira-Vidal, A.; Borge, M. J. G.; Tengblad, O.; Huerga, C.; Téllez, M. and Garcia, G (2008). Energy deposition model based on electron scattering cross section data from water molecules. Journal of Physics: Conference Series, 133 article no. 012002.

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Munoz, A.; Oller, J.C.; Blanco, F.; Gorfinkiel, J.D. and Garcia, G. (2007). Electron scattering cross sections and stopping powers in H2. Chemical Physics Letters, 433(4-6) pp. 253–258.

Bouchiha, D.; Gorfinkiel, J. D.; Caron, L. G. and Sanche, L. (2007). Low-energy electron collisions with methanol. Journal of Physics B: Atomic, Molecular and Optical Physics, 40(6) pp. 1259–1270.

Caron, Laurent; Bouchiha, D.; Gorfinkiel, J. D. and Sanche, L. (2007). Adapting gas-phase electron scattering R-matrix calculations to a condensed-matter environment. Physical Review A, 76(3) 032716.

Munoz, A.; Oller, J. C.; Blanco, F.; Gorfinkiel, J. D.; Limao-Vieira, P. and Garcia, G. (2007). Electron-scattering cross sections and stopping powers in H2O. Physical Review A, 76(5) 052707.

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Bouchiha, D.; Gorfinkiel, J.D.; Caron, L.G. and Sanche, L. (2006). Low-energy electron collisions with tetrahydrofuran. Journal of Physics B: Atomic, Molecular and Optical Physics, 39(4) pp. 975–986.

Halmov'a, Gabriela; Gorfinkiel, J. D. and Tennyson, Jonathan (2006). Low-energy electron collisions with C2 using the R-matrix method. Journal of Physics B: Atomic, Molecular and Optical Physics, 39(12) pp. 2849–2860.

2005To Top

Gorfinkiel, J.D. and Tennyson, J. (2005). Electron impact ionization of small molecules at intermediate energies: the molecular R-matrix with pseudostates method. Journal of Physics B: Atomic, Molecular and Optical Physics, 38(11) pp. 1607–1622.

2004To Top

Faure, A.; Gorfinkiel, J.D. and Tennyson, Jonathan (2004). Low-energy electron collisions with water: elastic and rotationally inelastic scattering. Journal of Physics B: Atomic, Molecular and Optical Physics, 37(4) pp. 801–807.

Faure, Alexandre; Gorfinkiel, Jimena D. and Tennyson, Jonathan (2004). Electron-impact rotational excitation of water. Monthly Notices of the Royal Astronomical Society, 347(1) pp. 323–333.

2002To Top

Gorfinkiel, J.D.; Morgan, L.A. and Tennyson, Jonathan (2002). Electron impact dissociative excitation of water within the adiabatic nuclei approximation. Journal of Physics B: Atomic, Molecular and Optical Physics, 35(3) pp. 543–555.

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