Full quantum calculations are performed to investigate the broadening profiles of the atomic lithium Li（2s-2p） resonance line induced by interactions with ground Ne（2s^22p^6） perturbers in the spectral wings and c...Full quantum calculations are performed to investigate the broadening profiles of the atomic lithium Li（2s-2p） resonance line induced by interactions with ground Ne（2s^22p^6） perturbers in the spectral wings and core. The X^2Σ~＋, A^2Π,and B^2Σ~＋ potential-energy curves of the two first low lying Li Ne molecular states, as well as the corresponding transition dipole moments, are determined with ab initio methods based on the SA-CASSCF-MRCI calculations. The emission and absorption coefficients in the wavelength range 550-800 nm and the line-core width and shift are investigated theoretically for temperatures ranging from 130 K to 3000 K. Their temperature dependence is analyzed, and the obtained results are compared with the previous experimental measurements and theoretical works.展开更多
文摘Full quantum calculations are performed to investigate the broadening profiles of the atomic lithium Li（2s-2p） resonance line induced by interactions with ground Ne（2s^22p^6） perturbers in the spectral wings and core. The X^2Σ~＋, A^2Π,and B^2Σ~＋ potential-energy curves of the two first low lying Li Ne molecular states, as well as the corresponding transition dipole moments, are determined with ab initio methods based on the SA-CASSCF-MRCI calculations. The emission and absorption coefficients in the wavelength range 550-800 nm and the line-core width and shift are investigated theoretically for temperatures ranging from 130 K to 3000 K. Their temperature dependence is analyzed, and the obtained results are compared with the previous experimental measurements and theoretical works.
