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1.
J Chem Phys ; 138(11): 114306, 2013 Mar 21.
Article in English | MEDLINE | ID: mdl-23534638

ABSTRACT

The 2(2)Σ(+) and 4(2)Σ(+) excited states of (7)Li(40)Ca have been studied by high resolution Fourier-transform spectroscopy. The data on the lower state, 2(2)Σ(+), were obtained by analyzing the rotationally resolved spectra of the thermal emission of LiCa in the 2(2)Σ(+) → X(2)Σ(+) band around 9500 cm(-1). These data contained transitions mainly from v' = 0 and 1 for N' up to 92 and allowed us to derive molecular parameters describing the potential curve of the state close to its minimum. The dataset on the second state, 4(2)Σ(+), is much larger and comes from a laser-induced fluorescence experiment. The levels were excited by a single mode dye laser and the 4(2)Σ(+) → X(2)Σ(+) fluorescence was recorded through a Fourier-transform spectrometer. For both states potential energy curves and Dunham coefficients were derived and the spin-rotation structure was evaluated. The results are compared with theoretical and experimental data from the literature.

2.
J Chem Phys ; 138(9): 094315, 2013 Mar 07.
Article in English | MEDLINE | ID: mdl-23485302

ABSTRACT

We studied the molecule LiRb in the gas phase with high resolution by Fourier-transform spectroscopy of laser induced fluorescence. The spectra were assigned to transitions between the ground state X(1)Σ(+) and B(1)Π or D(1)Π states and showed perturbations. For levels with e symmetry the coupling to the nearby state C(1)Σ(+) was included in the analysis by means of coupled channel calculations. The evaluation gives potential energy curves for all three electronic states and the coupling functions for B-C coupling, which are related to the expectation value of the electronic orbital angular momentum operator L(+) or L(-). The same coupling between C and D states is considered, but is not yet as fixed as in the case B-C because of lack of data. The model was extended to include the Λ-doubling by distant electronic states through effective q-parameters, but their interpretation is incomplete because of several possible perturbing states and too few data.

3.
J Chem Phys ; 135(17): 174303, 2011 Nov 07.
Article in English | MEDLINE | ID: mdl-22070298

ABSTRACT

The paper reports on a successful observation of high resolution Fourier transform spectra of LiCa. The fine structure of the ground state was observed and attributed to effective spin-rotation interaction. The experimental observations are described by two models using potential energy curves. One of them takes into account the fine structure splitting by means of effective constants, the other by means of a R dependent function γ(R), built in the radial Schrödinger equation. Ab initio calculations were performed for γ(R) which comes close to the experimental function.

4.
J Chem Phys ; 134(2): 024321, 2011 Jan 14.
Article in English | MEDLINE | ID: mdl-21241113

ABSTRACT

We report on the first experimental observation of the ground electronic state of the LiRb molecule at high resolution. A large body of experimental data was collected which led to an accurate potential energy curve for this state. Transitions to the lowest triplet state were also observed, but these data are rather fragmentary and allow only a first attempt for the description of this state. Both potentials were used for evaluating published Feshbach resonances of this molecule. We compare the results of this study with those of the related LiK and LiCs molecules.

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