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Molecular Physics

An International Journal at the Interface Between Chemistry and Physics

Volume 107, 2009 - Issue 19

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An experimental and computational study of the valence photoelectron spectra of halogenated pyrimidines

Patrick O'Keeffe CNR-IMIP Area della Ricerca di Roma 1, CP 10 00016 Monterotondo Scalo, ItalyCorrespondence[email protected]

Paola Bolognesi CNR-IMIP Area della Ricerca di Roma 1, CP 10 00016 Monterotondo Scalo, Italy

Anna Rita Casavola CNR-IMIP Area della Ricerca di Roma 1, CP 10 00016 Monterotondo Scalo, Italy

Daniele Catone CNR-ISM, Via del Fosso del Cavaliere 100, Rome, I-00133, Italy

Nicola Zema CNR-ISM, Via del Fosso del Cavaliere 100, Rome, I-00133, Italy

Stefano Turchini CNR-ISM, Via del Fosso del Cavaliere 100, Rome, I-00133, Italy

Lorenzo Avaldi CNR-IMIP Area della Ricerca di Roma 1, CP 10 00016 Monterotondo Scalo, Italy

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Pages 2025-2037 | Received 13 Feb 2009, Accepted 13 Jun 2009, Published online: 21 Sep 2009

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https://doi.org/10.1080/00268970903120328

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P. Bolognesi & L. Avaldi. (2022) Photoelectron–photoion(s) coincidence studies of molecules of biological interest. Physical Chemistry Chemical Physics 24:37, pages 22356-22370.
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Bruno Nunes Cabral Tenorio, Torben Arne Voß, Sergey I. Bokarev, Piero Decleva & Sonia Coriani. (2022) Multireference Approach to Normal and Resonant Auger Spectra Based on the One-Center Approximation. Journal of Chemical Theory and Computation 18:7, pages 4387-4407.
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Mónica Mendes, Fábris Kossoski, Ana I. Lozano, João Pereira-da-Silva, Rodrigo Rodrigues, João Ameixa, Nykola C. Jones, Søren V. Hoffmann & Filipe Ferreira da Silva. (2021) Excited States of Bromopyrimidines Probed by VUV Photoabsorption Spectroscopy and Theoretical Calculations. International Journal of Molecular Sciences 22:12, pages 6460.
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Paola Bolognesi, Antti Kettunen, Patrick O’Keeffe, Robert Richter, Antonella Cartoni, Anna Rita Casavola, Mattea C Castrovilli, Sanja Tosic, Bratislav P Marinkovic & Lorenzo Avaldi. (2020) Inner shell photofragmentation of 2Cl-pyrimidine studied by mass spectrometry and electron–ion coincidence experiments. Journal of Physics B: Atomic, Molecular and Optical Physics 53:24, pages 244004.
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Gilbert Grell & Sergey I. Bokarev. (2020) Multi-reference protocol for (auto)ionization spectra: Application to molecules. The Journal of Chemical Physics 152:7.
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M. C. Castrovilli, P. Bolognesi, E. Bodo, G. Mattioli, A. Cartoni & L. Avaldi. (2018) An experimental and theoretical investigation of XPS and NEXAFS of 5-halouracils. Physical Chemistry Chemical Physics 20:9, pages 6657-6667.
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Paola Bolognesi & Lorenzo Avaldi. 2017. Nanoscale Insights into Ion-Beam Cancer Therapy. Nanoscale Insights into Ion-Beam Cancer Therapy 209 235 .

K.C. Prince, P. Bolognesi, V. Feyer, O. Plekan & L. Avaldi. (2015) Study of complex molecules of biological interest with synchrotron radiation. Journal of Electron Spectroscopy and Related Phenomena 204, pages 335-344.
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P. Bolognesi, J. A. Kettunen, A. Cartoni, R. Richter, S. Tosic, S. Maclot, P. Rousseau, R. Delaunay & L. Avaldi. (2015) Site- and state-selected photofragmentation of 2Br-pyrimidine. Physical Chemistry Chemical Physics 17:37, pages 24063-24069.
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Mattea Carmen Castrovilli, Paola Bolognesi, Antonella Cartoni, Daniele Catone, Patrick O’Keeffe, Anna Rita Casavola, Stefano Turchini, Nicola Zema & Lorenzo Avaldi. (2014) Photofragmentation of Halogenated Pyrimidine Molecules in the VUV Range. Journal of the American Society for Mass Spectrometry 25:3, pages 351-367.
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Wania Wolff, Hugo Luna, Lucas Sigaud, Andre C. Tavares & Eduardo C. Montenegro. (2014) Absolute total and partial dissociative cross sections of pyrimidine at electron and proton intermediate impact velocities. The Journal of Chemical Physics 140:6.
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M. A. Śmiałek, E. Szymańska, M. MacDonald, L. Zuin & N. J. Mason. (2013) Photoelectron spectroscopy of brominated derivative of pyrimidine: 2-bromopyrimidine. The European Physical Journal Special Topics 222:9, pages 2361-2366.
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Zejin Yang, Patrick Duffy & Feng Wang. (2013) Inheritance and correlation of nucleic acid pyrimidine bases. International Journal of Quantum Chemistry, pages n/a-n/a.
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P. Bolognesi, M.C. Castrovilli, P. O’Keeffe, A.R. Casavola, D. Catone, S. Turchini & L. Avaldi. (2012) Photofragmentation of organic molecules of biological interest: The pyrimidine and 2Br–pyrimidine cases. Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms 279, pages 118-123.
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P. Bolognesi, P. O'Keeffe, Y. Ovcharenko, L. Avaldi & V. Carravetta. (2012) Resonant Auger spectroscopy at the carbon and nitrogen K-edges of pyrimidine. The Journal of Chemical Physics 136:15.
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J. D. Builth-Williams, S. M. Bellm, D. B. Jones, Hari Chaluvadi, D. H. Madison, C. G. Ning, B. Lohmann & M. J. Brunger. (2012) Experimental and theoretical investigation of the triple differential cross section for electron impact ionization of pyrimidine molecules. The Journal of Chemical Physics 136:2.
Crossref

P. Bolognesi, P. O’Keeffe & L. Avaldi. 2012. Radiation Damage in Biomolecular Systems. Radiation Damage in Biomolecular Systems 165 176 .

Alberto Modelli, Paola Bolognesi & Lorenzo Avaldi. (2011) Temporary Anion States of Pyrimidine and Halopyrimidines. The Journal of Physical Chemistry A 115:39, pages 10775-10782.
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P. Bolognesi, P. O’Keeffe, Y. Ovcharenko, M. Coreno, L. Avaldi, V. Feyer, O. Plekan, K. C. Prince, W. Zhang & V. Carravetta. (2010) Pyrimidine and halogenated pyrimidines near edge x-ray absorption fine structure spectra at C and N K-edges: experiment and theory. The Journal of Chemical Physics 133:3.
Crossref

P. Bolognesi, G. Mattioli, P. O’Keeffe, V. Feyer, O. Plekan, Y. Ovcharenko, K. C. Prince, M. Coreno, A. Amore Bonapasta & L. Avaldi. (2009) Investigation of Halogenated Pyrimidines by X-ray Photoemission Spectroscopy and Theoretical DFT Methods. The Journal of Physical Chemistry A 113:48, pages 13593-13600.
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An experimental and computational study of the valence photoelectron spectra of halogenated pyrimidines

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An experimental and computational study of the valence photoelectron spectra of halogenated pyrimidines

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