Hypergeometric resummation approach to dissociation and Stark effect in non-rigid dipolar molecules
Creators
- 1. Department of Materials and Production, Aalborg University, DK-9220 Aalborg Øst (Denmark)
Description
In a strong electric field, a dipolar molecule will contract or expand and, in extreme cases, dissociate. Considering a two-atomic non-rigid dipole described by the realistic Kratzer model, we compute analytical energy corrections up to fourth order in the field strength for general states and ninth order for the ground state. The fourth-order series is subsequently 'resummed' using the hypergeometric approach (Mera et al 2015 Phys. Rev. Lett. 115 143001). We benchmark the approach against numerical complex scaling results and demonstrate that the resummed series is highly accurate in a wide range of field strengths and, importantly, correctly reproduces the dissociation rate. Finally, Stark shift and dissociation rate are calculated for LiH+ as a practical application of the theory. (paper)
Availability note (English)
Available from http://dx.doi.org/10.1088/1361-6455/ab999bAdditional details
Identifiers
Publishing Information
- Journal Title
- Journal of Physics. B, Atomic, Molecular and Optical Physics
- Journal Volume
- 53
- Journal Issue
- 17
- Journal Page Range
- [7 p.]
- ISSN
- 0953-4075
- CODEN
- JPAPEH
INIS
- Country of Publication
- United Kingdom
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 52055865
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS;
- Descriptors DEI
- BENCHMARKS; CALCULATION METHODS; CORRECTIONS; DIPOLES; DISSOCIATION; ELECTRIC FIELDS; GROUND STATES; MOLECULES; STARK EFFECT
- Descriptors DEC
- ENERGY LEVELS; MULTIPOLES