E-Dissertationen: Auflistung E-Dissertationen nach Autor "Ehlert, Sebastian"
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From Density Functional Theory to Tight Binding: Development of Robust and Efficient Quantum Chemistry Methods
Ehlert, Sebastian (2022-12-07)The main topics of this thesis are efficient quantum chemical methods, their development, and the verification using existing and newly devised benchmark sets. The spectrum of quantum chemical methods discussed here includes ...