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Hittade 1 avhandling innehållade ordet fulvene.
1. Ground and Excited State Aromaticity : Design Tools for π-Conjugated Functional Molecules and Materials
Sammanfattning : The main focus of this thesis is on the aromaticity of the ground state and electronically excited states of π-conjugated molecules and polymers, as well as how aromaticity is connected to their properties.The electronic structures of polybenzenoid hydrocarbons (PBHs) were explored through density functional theory (DFT) calculations and the π-component of the electron localization function (ELFπ). LÄS MER
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