NO2 Isotopologue Spectroscopy
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We continue to collaborate with Prof. Remy Jost, of the Universite Joseph Fourier-CNRS Spectrométrie Physique in Grenoble, France investigating the role of isotopic symmetry in the energy spectrum. Our published results determined the zero point energy shift for six isotopologues of NO
2 (
click here for PDF) and calculated the ZPE shift for several triatomic molecules. We also evaluated the how symmetry impacts the density of states by determining the density differences between symmetric and asymmetric NO
2 isotopologues (
see it here). We found ~ 10% more rovibronic states in the asymmetric molecule relative to the symmetric configuration. It has been suggested that additional number of bound states gives high energy, asymmetric molecules a longer lifetime allowing them to be more effectively quenched to the ground state. It has been hypothesized that his mechanism is the origin of mass-independent fractionations (MIF). Our current work is to determine whether MIF occurs in NO
2 formation/decomposition reactions