diff --git a/README.md b/README.md index b0836fb..c8d512f 100644 --- a/README.md +++ b/README.md @@ -8,7 +8,9 @@ Article : Testing the limitations of harmonic approximation in the determination of Raman intensities + e2069613, Molecular Physics (2022) [https://doi.org/10.1080/00268976.2022.2069613]((10.1080/00268976.2022.2069613)) + --- Set of python functions and datasets (rovibrational wavefunctions and polarizabilities) used to test the double harmonic approximation for computing Raman intensities of the fundamental vibration in selected diatomic molecules.