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Update README.md
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ankit7540 authored Aug 9, 2019
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`spectra_H2(T, J_{Stokes}, J_{anti-Stokes})`, and similar for HD and D<sub>2</sub> : for computing spectra. Here, temperature T is in Kelvin. `J_{Stokes}` and `J_{anti-Stokes})` represents the maximum rotational J whose intensity is to be computed. Intensities are computed for `J=J_{anti-Stokes},.., J_{Stokes}`. Computed intensities are relative normalized intensities.
`spectra_H2(T, J_{Stokes}, J_{anti-Stokes})`, and similar for HD and D<sub>2</sub> : For computing spectra (normalized relative Raman intensities for pure rotation in the three gases). Here, temperature T is in Kelvin. `J_{Stokes}` and `J_{anti-Stokes})` represents the maximum rotational J whose intensity is to be computed. Intensities are computed for `J=J_{anti-Stokes},.., J_{Stokes}`. Computed intensities are relative normalized intensities.

Functions can be used directly for computing the sum of states for the three gases for given temperature (for example, `sumofstate_D2(298)`). When computing spectra the sum of states are computed within the function (for example, `spectra_H2(298, 6, 6)`) for obtaining the Boltzmann populations.

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