## /data

This data achieve contains experimental neutron reflectometry data from the ISIS Neutron and Muon Source as well as molecular dynamics simulation trajectories.

Within the data directory, there are two directories and a file:

- `experimental`: this contains the neutron reflectometry data (these are space separated files containing q-vector, reflected intensity, and the uncertainty in the reflected intensity), that is initially sorted by surface pressure in mN/m, then by contrast
- `simulation`: this contains the molecular dynamics simulation data, this is sorted initially by the force field, and then by the apparent surface pressure (again in mN/m)
- `surf_iso.csv`: this is a short `csv` file that gives the surface pressure-isotherm data (containing surface pressure (sp) and area per molecule (apm)), taken from the work of Kubo et al. (DOI: 10.1016/S0040-6090(01)01101-4)