atomistics.shared.thermal_expansion.get_thermal_expansion_output

atomistics.shared.thermal_expansion.get_thermal_expansion_output#

atomistics.shared.thermal_expansion.get_thermal_expansion_output(temperatures_lst: ndarray, volumes_lst: ndarray, output_keys: Iterable[str]) dict[source]#

Get the thermal expansion output.

Parameters: temperatures_lst (np.ndarray): Array of temperatures. volumes_lst (np.ndarray): Array of volumes. output_keys (tuple[str]): Tuple of output keys.

Returns: dict: Dictionary containing the thermal expansion output.