Title: H2O-HCN complex: A new potential energy surface and intermolecular rovibrational states from rigorous quantum calculations

Authors: P Vindel-Zandbergen, D Kędziera, M Żołtowski, J Kłos, …

DOI: https://chemrxiv.org/engage/chemrxiv/article-details/64e7aa1d79853bbd78590af8

Date: 2023-09-14 21:26:44

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Abstract: In this work the H2O-HCN complex is quantitatively characterized in two ways. First, we report a new rigid-monomer 5D intermolecular potential energy surface (PES) for this complex, …