Updated the headings for the ouput so that they make more sense and correctly ouput total_trace and total_thermal_energy
Updated the headings for the ouput so that they make more sense and correctly ouput total_trace and total_thermal_energy

hande-qmc/hande,hande-qmc/hande,hande-qmc/hande,ruthfranklin/hande,hande-qmc/hande,hande-qmc/hande