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Replication data of Kästner group for: "Tungsten Sulfido Alkylidene and Catio... Dataset
In this dataset, all simulation data are listed. That includes all geometry optimizations and single-point calculations including population analysis (Natural population... -
Replication data of C4 group for: "Interplay of Polarity and Confinement in A... Dataset
In this dataset, all simulation data are listed. That includes all geometry optimizations, single-point calculations, and IBO calculations. Furthermore, thermal corrections for...
