期刊
MOLECULAR PHYSICS
卷 111, 期 12-13, 页码 1781-1797出版社
TAYLOR & FRANCIS LTD
DOI: 10.1080/00268976.2013.793835
关键词
potential-energy curves; coupled-cluster theory; induced-dipole interaction; AC Stark effect; far-off-resonant laser field
资金
- Polish Ministry of Science and Higher Education [N N204 215539]
- Spanish project (MICINN) [FIS2011-24540]
- Spanish project (Junta de Andalucia) [P11-FQM-7276, FQM-4643]
- Foundation for Polish Science MPD Programme
- EU European Regional Development Fund
- Foundation for Polish Science within the MISTRZ programme
- National Science Foundation [NSF PHY11-25915]
We formulate the theory for a diatomic molecule in a spatially degenerate electronic state interacting with a non-resonant laser field and investigate its rovibrational structure in the presence of the field. We report on ab initio calculations employing the double electron attachment intermediate Hamiltonian Fock space coupled cluster method restricted to single and double excitations for all electronic states of the Rb-2 molecule up to 5s+5d dissociation limit of about 26,000cm(-1). In order to correctly predict the spectroscopic behaviour of Rb-2, we have also calculated the electric transition dipole moments, non-adiabatic coupling and spin-orbit coupling matrix elements, and static dipole polarisabilities, using the multireference configuration interaction method. When a molecule is exposed to strong non-resonant light, its rovibrational levels get hybridised. We study the spectroscopic signatures of this effect for transitions between the X-1 sigma(+) (g) electronic ground state and the A(1)sigma(+) (u) and b(u)(3) excited state manifold. The latter is characterised by strong perturbations due to the spin-orbit interaction. We find that for non-resonant field strengths of the order 10(9) W/cm(2), the spin-orbit interaction and coupling to the non-resonant field become comparable. The non-resonant field can then be used to control the singlet-triplet character of a rovibrational level.
作者
我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。
推荐
暂无数据