Sökning: "Agris Klimkans"

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1. 1. Quantum Mechanical Studies of Electron Transport Processes Including Superconductivity

   Författare :Agris Klimkans; Chalmers tekniska högskola; []
   Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; quantum chemical calculations; ab initio; electronic;

   Sammanfattning : Processes of electron transfer, charge and spin localization, and electron pair transfer have been studied on the basis of the Marcus model and with the help of accurate quantum chemical calculations. A vibrational model, based on the corrections to the Born-Oppenheimerapproximation, which applies in the case of a vanishing barrier in the Marcus model, has been proposed. LÄS MER