Sökning: "Tomoko Akiyama"

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1. 1. Ionization Influence on the Dynamics of Simple Organic Molecules

   Författare :Tomoko Akiyama; Carl Caleman; Oscar Grånäs; Olle Björneholm; Maria Hahlin; Uppsala universitet; []
   Nyckelord :Small organic molecule; Density functional theory; bond integrity; Symmetric structure;

   Sammanfattning : This licentiate thesis is devoted to the investigation of how bonding in simple organic molecules are affected by X-ray beam irradiation. The investigation targets molecules with three carbons as their main-chain structure. The stability of the bonds under ionization are simulated using the SIESTA package. LÄS MER