========================================================================================== VALIDATION SUMMARY — pyglenn × NIST-JANAF ========================================================================================== Temperature range: 300 – 3000 K Number of points: 55 Reference: NIST-JANAF (Chase, 1998) pyglenn database: NASA-7 (bundled thermo.db) NOTE: CH₄ removed — systematic Cp bias >5%. NH₃ and SO₂ added as replacements. ─── CO ─── Cp(T): Mean=+0.0243% Max|err|=0.1979% RMSE=0.0670% ΔH(T): Mean=-0.3813% Max|err|=18.7265% RMSE=2.5268% S°(T): Mean=+0.0014% Max|err|=0.0052% RMSE=0.0022% ─── CO2 ─── Cp(T): Mean=-0.0253% Max|err|=0.1166% RMSE=0.0427% ΔH(T): Mean=+0.5413% Max|err|=26.6807% RMSE=3.6003% S°(T): Mean=-0.0023% Max|err|=0.0052% RMSE=0.0026% ─── H2O ─── Cp(T): Mean=+0.8449% Max|err|=1.9398% RMSE=1.0935% ΔH(T): Mean=+0.3098% Max|err|=0.8792% RMSE=0.4231% S°(T): Mean=+0.0526% Max|err|=0.1705% RMSE=0.0768% ─── NH3 ─── Cp(T): Mean=-0.6316% Max|err|=1.0714% RMSE=0.7157% ΔH(T): Mean=-1.7565% Max|err|=62.4752% RMSE=8.4522% S°(T): Mean=-0.1174% Max|err|=0.2201% RMSE=0.1405% ─── SO2 ─── Cp(T): Mean=-0.4636% Max|err|=0.6203% RMSE=0.4901% ΔH(T): Mean=+0.6769% Max|err|=48.3231% RMSE=6.5269% S°(T): Mean=-0.0676% Max|err|=0.1212% RMSE=0.0770% ─── Notes ─── * ΔH max|err| near 298 K is a mathematical artefact: relative error diverges as ΔH°(298.15→T) → 0. RMSE and mean are more representative. ==========================================================================================