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Quantum Molecular Calculations

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2 results in Keywords: Quantum Molecular Calculations

Physical Chemistry

HF trimer: A new full-dimensional potential energy surface and rigorous 12D quantum calculations of vibrational states

Jia Li, Patricia Vindel Zandbergen, Jun Li, Peter Felker, Zlatko Bacic

Version 1 posted 04 June 2024

126

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Physical Chemistry

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

Patricia Vindel-Zandbergen, Dariusz Kędziera, Michał Żołtowski, Jacek Kłos, Piotr Żuchowski, Peter Felker, François Lique, Zlatko Bačić

Version 1 posted 25 August 2023

180

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