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DFT-TD-DFT molecular design of porphyrin analogues for use in dye-sensitized solar cells

Balanay Mannix P./Kim DOng Hee

Phys. Chem. Chem. Phys., vol: 10, num: 33, 5121-5127, published: 20 May 2008,


   Atoms and molecules.
      Electronic shells of molecules.
         Wave functions, molecular integrals.

   Atoms and molecules.
      Interaction of atoms and molecules with external fields and radiation.
         Transitions between electronic states.
            Lifetimes and transition probabilities for molecules.

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