KINISOT.py v 2.0.1: 2023-09-11 11:16 Temp = 195.15K / Vib. scale factor = 0.9806 V-ratio ZPE EXC TRPF KIE 1D-tunn corr-KIE o endo-React-OBS-gas-phase -------------------------------------------------------------------------- o endo-TS-OBS-gas-phase 390.0 o endo-React-OBS-gas-phase: iso @ 14 2.086e+02 1.061e+00 2.653e+00 o endo-TS-OBS-gas-phase: iso @ 14 375.6 1.682e+02 1.035e+00 2.771e+00 -------------------------------------------------------------------------- KIE @ 195.15 K 1.038398 1.240026 1.025398 0.957415 1.264116 1.029548 1.301467 -------------------------------------------------------------------------- KIE = 2.844390/1.301467 = 2.185526025631076