TPT coefficients for ellipsoidal molecules

This data set comprises calculated values of the perturbed Helmholtz free energy coefficients, considering a Hard Gaussian Overlap fluid as the reference term and an attractive spherically symmetric square-well potential as the perturbed term. All the calculations were performed with Monte Carlo simulations. The code is available at: https://github.com/LESC-Unicamp/TPT-coefficients-for-ellipsoidal-molecules