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P. Felker

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Aug 2026

Hydrogen-bonded molecular trimers: Vibration-tunneling states and low-frequency spectra from rigorous high-dimensional quantum calculations.

Noncovalently bound molecular trimers, held together by hydrogen-bonded and van der Waals interactions, are the smallest clusters in which the three-body interactions can manifest. Accurate description of these nonadditive interactions is of great importance since they play a crucial role in shaping the energetics, str...

Z. Bačić, Irén Simkó, P. Felker · 0 citations

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