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physics.chem-ph2026
Different Environments in Quantum Statistical Mechanics: To or not to
Ellen T. Ekstrøm, Jacob Pedersen, Ida-Marie Høyvik
We piece together textbook material to re-derive the parameter entering reduced density operators from quantum statistical mechanics. By re-deriving , we show that the conte…
physics.chem-ph2026
The X-ray absorption spectrum of the propargyl radical, CH
Dorothee Schaffner, Theo Juncker von Buchwald, Jacob Pedersen +8
We report a combined experimental and computational study of the near-edge X-ray absorption fine structure (NEXAFS) spectrum of the propargyl radical, CH. As a cent…