From Accurate Quantum Chemistry to Converged Thermodynamics for Ion Pairing in Solution

Fuente: arXiv
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Bibliographic Details
Main Authors: O'Neill, Niamh, Shi, Benjamin X., Witt, William C., Armstrong, Blake I., Baldwin, William J., Raiteri, Paolo, Schran, Christoph, Michaelides, Angelos, Gale, Julian D.
Format: Preprint
Published: 2026
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