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- W2196900072 abstract "The vertical electron detachment energies (VDE) of three Mg2F5- anions were calculated at the outer valence Green function level with the 6-311 + G(3df) basis sets. This species was found to form unusual geometrical structures each of which corresponds to an anionic state exhibiting superhalogen nature. The global minimum structure was described as a system in which two central magnesium atoms are linked via symmetrical triangle formed by three fluorine atoms. Extremely large electron binding energies of these anions (exceeding 8.5 eV in all cases) were predicted and discussed." @default.
- W2196900072 created "2016-06-24" @default.
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- W2196900072 date "2007-05-01" @default.
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- W2196900072 title "Unusual structures of <mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML altimg=si7.gif display=inline overflow=scroll><mml:mrow><mml:msub><mml:mrow><mml:mtext>Mg</mml:mtext></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub><mml:msubsup><mml:mrow><mml:mtext>F</mml:mtext></mml:mrow><mml:mrow><mml:mn>5</mml:mn></mml:mrow><mml:mrow><mml:mo>-</mml:mo></mml:mrow></mml:msubsup></mml:mrow></mml:math> superhalogen anion" @default.
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- W2196900072 doi "https://doi.org/10.1016/j.cplett.2007.04.016" @default.
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