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Accurate potential for the ground state of the hydrogen molecule
Affiliation:1. Department of Nuclear Engineering, Seoul National University, Seoul 151-744, South Korea;2. Korea Atomic Energy Institute, Daejeon, South Korea;3. GSCST, Seoul National University, Seoul 151-744, South Korea;1. Institute of Physics, Faculty of Physics, Astronomy and Informatics, Nicolaus Copernicus University in Toruń, Grudziadzka 5, Torun 87-100, Poland;2. Hefei National Laboratory for Physical Sciences at Microscale, iChEM, University of Science and Technology of China, Hefei, 230026 China;3. University of Grenoble Alpes, CNRS, LIPhy, Grenoble F-38000, France;4. Department of Chemistry and Biochemistry, Auburn University, Auburn, AL 36849 USA;5. Univ Rennes, CNRS, IPR (Institut de Physique de Rennes) - UMR 6251, Rennes F-35000, France
Abstract:Starting from the spectroscopic constants, an electronic potential for the ground state hydrogen molecule is presented. Self-consistence is checked by numerical integration of the radial wave equation. The mean eigenvalue deviation is about 1 cm−1. Comparison with the latest theoretical work is considered. New revised spectroscopic constants and vibrational quanta are calculated.
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