BoltzTraP2-post-processing

The script provided (BTP2-extract.py) is designed to process BoltzTraP2 output files (*.trace), perform unit conversions, adjust the chemical potential by subtracting the Fermi energy, and generate various plots for data analysis.

Key Functionalities:
• Load and Process Data: Reads the input data file and processes it into a usable format.
• Unit Conversion: Automatically detects and converts the unit of Ef (Rydberg, Hartree, or eV) to eV.
• Fermi Energy Adjustment: Optionally subtracts the provided Fermi energy from the chemical potential.
• Data Conversion: Converts the Seebeck coefficient from V/K to µV/K.
• Plot Generation: Offers multiple plotting options to visualize different physical properties.