atomistics.workflows.evcurve.fit.get_energy_volume_curve_fit#
- atomistics.workflows.evcurve.fit.get_energy_volume_curve_fit(volume_lst: ndarray | None = None, energy_lst: ndarray | None = None) EnergyVolumeFit[source]#
Create an instance of EnergyVolumeFit class with the given volume and energy lists.
- Parameters:
volume_lst (np.ndarray, optional) – Vector of volumes. Defaults to None.
energy_lst (np.ndarray, optional) – Vector of energies. Defaults to None.
- Returns:
Instance of EnergyVolumeFit class.
- Return type: