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Pressure dependent stability and structure of carbon dioxide—A density functional study including long-range corrections

Sebastian Gohr, Stefan Grimme, Tilo Söhnel, Beate Paulus,Peter Schwerdtfeger

J. Chem. Phys., vol: 139, num: 17, , published: 07 November 2013, 174501


   Structure and lattice dynamics of solids.
      Chemical bonds and crystalline fields.
         Bonds in molecular crystals.

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