Auflistung nach Autor "Zaby, Paul"
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A Quantum Cluster Equilibrium Theory for Multi-Component Liquids
Frömbgen, Tom; Drysch, Katrin; Zaby, Paul; Dölz, Jürgen; Ingenmey, Johannes; Kirchner, Barbara (2024-02-19)In this work, we present a new theory to treat multi-component liquids based on quantum-chemically calculated clusters. The starting point is the binary quantum cluster equilibrium theory that is able to treat binary ...