Wyniki wyszukiwania dla: supramolecular junction

• Supramolecular junctions of the PDA tetramers

  Dane Badawcze

  open access

  • A. Olejnik
  • R. Bogdanowicz
  • J. Ryl

  - seria: Electrochemical Au-Minecraft: a new approach towards the impedimetric biosensing system

  In this dataset, a set of polydopamine (PDA) supramolecular junctions with linear and cyclic tetramers in different oxidation states (indolequinone , IQ or dihydroxyindole, DHI) in the scattering region are investigated. Electronic structure of the supramolecular junction with cyclic and linear PDA tetramers, including Electron density maps for the...

• Interactions of PDA tetramers with the Au surfaces

  Dane Badawcze

  open access

  • A. Olejnik
  • R. Bogdanowicz
  • J. Ryl

  - seria: Electrochemical Au-Minecraft: a new approach towards the impedimetric biosensing system

  This dataset contains electrostatic difference potential (EDP) maps, density of states (DOS) spectra, and adsorption geometries of cyclic tetramers on the Au surface. The real polydopamine was modelled either as the cyclic tetramers in the oxidised (indolequinone, IQ) and reduced (dihydroxyindole, DHI) chemistries with all units being the same - either...

• Interaction of PDA monomers with Au

  Dane Badawcze

  open access

  • A. Olejnik
  • R. Bogdanowicz
  • J. Ryl

  - seria: Electrochemical Au-Minecraft: a new approach towards the impedimetric biosensing system

  This dataset contains supplementary information in the form of Electrostatic difference potential (EDP) map, density of states (DOS) spectra, and adsorption geometries of polydopamine PDA monomers on the Au surface. PDA was modelled either as the oxidised (indolequinone, IQ) and reduced (dihydroxyindole, DHI) chemistries.