Model Potential Calculations for the Ground and Various Excited States of LiNa+
The Journal of Physical Chemistry A2000Vol. 105(1), pp. 165–168
Citations Over TimeTop 19% of 2000 papers
Abstract
A theoretical investigation of the electronic structure of the molecular ion LiNa+ (adiabatic potential energy curves, rovibrational energies, spectroscopic constants and dipole moments) has been performed in the framework of a model potential method. Such information, not yet available to the best of our knowledge except for the ground state, constitutes the input data for simulations of above threshold dissociation of LiNa+. Although most of the energy curves are found to be dissociative, some present potential wells located at intermediate internuclear distances. A long-range extrapolation is proposed for the lowest states.
Related Papers
- → MR-ccCA: A route for accurate ground and excited state potential energy curves and spectroscopic properties for third-row diatomic molecules(2014)12 cited
- → Electronic structure and rovibrational predissociation of the 21Π state in KLi(2018)7 cited
- → Potential Energy Curves and Dissociation Energies for Some Diatomic Molecules by Using Two Different Functions(2016)3 cited
- → Three-dimensional ab initio potential-energy surface and rovibrational spectra of the H2–Kr complex(2005)13 cited
- Ground equilibrium structure and analytical potential energy function for Na_2H(2006)