Long-range three-body atom-diatom potential for doublet Li${}_3$

Details Long-range three-body atom-diatom potential for doublet Li${}_3$ Long-range three-body atom-diatom potential for doublet Li${}_3$

2011-05-05

arxiv.org/abs/1105.1090v2

Physics

Chemical Physics

Scientific paper

An accurate long-range {\em ab initio} potential energy surface has been calculated for the ground state ${}^2A'$ lithium trimer in the frozen diatom approximation using all electron RCCSD(T). The {\em ab initio} energies are corrected for basis set superposition error and extrapolated to the complete basis limit. Molecular van der Waals dispersion coefficients and three-body dispersion damping terms for the atom-diatomic dissociation limit are presented from a linear least squares fit and shown to be an essentially exact representation of the {\em ab initio} surface at large range.

Affiliated with

Also associated with

No associations

Rating

Long-range three-body atom-diatom potential for doublet Li${}_3$ does not yet have a rating. At this time, there are no reviews or comments for this scientific paper.

If you have personal experience with Long-range three-body atom-diatom potential for doublet Li${}_3$, we encourage you to share that experience with our LandOfFree.com community. Your opinion is very important and Long-range three-body atom-diatom potential for doublet Li${}_3$ will most certainly appreciate the feedback.

Rate now

Comments { 0 }

Profile ID: LFWR-SCP-O-690920