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The PtAl<sup>−</sup> and PtAl<sub>2</sub><sup>−</sup> anions : Theoretical and photoelectron spectroscopic characterization

The PtAl and PtAl2 anions : Theoretical and photoelectron spectroscopic characterization

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ZHANG, Xinxing, Gerd GANTEFÖR, Kit H. BOWEN, Anastassia N. ALEXANDROVA, 2014. The PtAl and PtAl2 anions : Theoretical and photoelectron spectroscopic characterization. In: The Journal of Chemical Physics. 140(16), 164316. ISSN 0021-9606. eISSN 1089-7690. Available under: doi: 10.1063/1.4873160

@article{Zhang2014anion-31397, title={The PtAl and PtAl2 anions : Theoretical and photoelectron spectroscopic characterization}, year={2014}, doi={10.1063/1.4873160}, number={16}, volume={140}, issn={0021-9606}, journal={The Journal of Chemical Physics}, author={Zhang, Xinxing and Ganteför, Gerd and Bowen, Kit H. and Alexandrova, Anastassia N.}, note={Article Number: 164316} }

Zhang, Xinxing Zhang, Xinxing 2015-07-08T09:55:43Z 2015-07-08T09:55:43Z Bowen, Kit H. The PtAl<sup>−</sup> and PtAl<sub>2</sub><sup>−</sup> anions : Theoretical and photoelectron spectroscopic characterization Ganteför, Gerd Ganteför, Gerd We report a joint photoelectron spectroscopic and theoretical study of the PtAl(-) and PtAl2(-) anions. The ground state structures and electronic configurations of these species were identified to be C<sub>∞v</sub>, <sup>1</sup>Σ<sup>+</sup> for PtAl<sup>-</sup>, and C<sub>2v</sub>, <sup>2</sup>B<sub>1</sub> for PtAl<sub>2</sub><sup>-</sup>. Structured anion photoelectron spectra of these clusters were recorded and interpreted using ab initio calculations. Good agreement between theory and experiment was found. All experimental features were successfully assigned to one-electron transitions from the ground state of the anions to the ground or excited states of the corresponding neutral species. Bowen, Kit H. eng Alexandrova, Anastassia N. Alexandrova, Anastassia N. 2014

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