Molecular structures of HO2, H2O, and the three HO2‚‚‚ H2O dimers

Download scientific diagram | Molecular structures of HO2, H2O, and the three HO2‚‚‚ H2O dimers determined at the MP2/6-31G* level of theory. Key interatomic distances (angstroms) and angles (degrees) are given. from publication: Exploration of the Potential Energy Surfaces, Prediction of Atmospheric Concentrations, and Prediction of Vibrational Spectra for the HO 2 ···(H 2 O) n ( n = 1−2) Hydrogen Bonded Complexes | The hydroperoxy radical (HO2) plays a critical role in Earth's atmospheric chemistry as a component of many important reactions. The self-reaction of hydroperoxy radicals in the gas phase is strongly affected by the presence of water vapor. In this work, we explore the | Hydrogen Bonding, Potential Energy Surfaces and Infrared Spectrophotometry | ResearchGate, the professional network for scientists.

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PDF) Exploration of the Potential Energy Surfaces, Prediction of Atmospheric Concentrations, and Prediction of Vibrational Spectra for the HO 2 ···(H 2 O) n ( n = 1−2) Hydrogen Bonded Complexes

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