Modified Rosen-Morse potential-energy model for diatomic molecules
Guangdong Zhang, Jianyi Liu, Liehui Zhang, Wen Zhou, Chun‐Sheng Jia
Abstract
Guangdong Zhang, Jianyi Liu, Liehui Zhang, Wen Zhou, Chun‐Sheng Jia
Abstract
By employing the dissociation energy and the equilibrium bond length for a diatomic molecule as explicit parameters, we generate an improved expression for the generalized Woods-Saxon potential. It is exactly shown that the generalized Woods-Saxon potential and the well-known Rosen-Morse potential are the same empirical potential-energy function for diatomic molecules. Based on the measure of inner-shell radii of two atoms, we propose a modified Rosen-Morse potential-energy model. Evaluation of the average deviations from the experimental data is carried out on six molecules. The modified Rosen-Morse potential is found to be more accurate than the Morse and Rosen-Morse potentials in fitting experimental data for the six molecules examined.
OpenAlex reports 76 citations for this work. Citation counts describe recorded attention and do not establish research quality.
A contribution statement is not available in the OpenAlex record.
Method details are not available in the OpenAlex metadata.
Findings are not separately available in the OpenAlex metadata.
Limitations are not available in the OpenAlex metadata.
Application details are not available in the OpenAlex metadata.
By employing the dissociation energy and the equilibrium bond length for a diatomic molecule as explicit parameters, we generate an improved expression for the generalized Woods-Saxon potential. It is exactly shown that the generalized Woods-Saxon potential and the well-known Rosen-Morse potential are the same empirical potential-energy function for diatomic molecules. Based on the measure of inner-shell radii of two atoms, we propose a modified Rosen-Morse potential-energy model. Evaluation of the average deviations from the experimental data is carried out on six molecules. The modified Rosen-Morse potential is found to be more accurate than the Morse and Rosen-Morse potentials in fitting experimental data for the six molecules examined.
Key concepts: Diatomic molecule, Morse potential, Physics, Potential energy, Morse code, Bond-dissociation energy, Molecule, Morse theory