datafiles: Contains the thermal conductivity vs. impurity concentration data scraped from literature for several point defect scattering studies
format for data file: values in side parenthesis correspond to example values for the compound []Co4Sb12 substituted with CeCo4Sb12, where [] indicates a vacany
Stoichiometry (1 4 12) Mass of each site in native material (0, 58.93, 121.96) Mass of each site in impurity material (140.116, 55.845, 121.76) Radius of each site in native material Radius of each site in impurity material DebyeTemperature VolumePerAtom Impuriy Concentration, Thermal Conductivity
scripts: Python scripts which apply the Klemens mass fluctuation scattering and strain fluctuation scattering to model data of thermal conductivity versus impurity concentration