{ "ANCILLARIES": { "hL": { "A": [ -44755.043643580284, 187.3274060247385, 0.022180693375846047, -0.0018945351568552462, 9.051589894935887e-06, -2.538123490519804e-08, 3.8971372740286484e-11, -2.6685452818773097e-14 ], "B": [ 1, -0.0026659217850497135 ], "Tmax": 369.78999999999996, "Tmin": 85.525, "_note": "coefficients are in increasing order; input in K, output in J/mol; value is enthalpy minus hs_anchor enthalpy", "max_abs_error": 280.1843383364994, "max_abs_error_units": "J/mol", "type": "rational_polynomial" }, "hLV": { "A": [ 28027.43347159743, -87.51145055515036, -0.5641568879088571, 0.006749038230355905, -3.5165597979250975e-05, 1.0133818422083623e-07, -1.5718327954358495e-10, 1.046837739036196e-13 ], "B": [ 1, -0.002664434280304393 ], "Tmax": 369.78999999999996, "Tmin": 85.525, "_note": "coefficients are in increasing order; input in K, output in J/mol; value is enthalpy minus hs_anchor enthalpy", "max_abs_error": 623.8773557534162, "max_abs_error_units": "J/mol", "type": "rational_polynomial" }, "melting_line": { "BibTeX": "Reeves-JCP-1964", "T_m": 85.39999999999998, "parts": [ { "T_0": 85.525, "T_max": 175, "T_min": 85.525, "a": 718000000.0, "c": 1.283, "p_0": 0.00017207065534365437 } ], "type": "Simon" }, "pS": { "T_r": 369.89, "Tmax": 369.8899999999991, "Tmin": 85.52500000000002, "description": "p'' = pc*exp(Tc/T*sum(n_i*theta^t_i))", "max_abserror_percentage": 0.016222893634509905, "n": [ -23.998635747391152, 18.313017605233238, -0.42240851966839504, -2.7378298813798962, 0.257888414168987, -1.3113462226130785 ], "reducing_value": 4251200.0, "t": [ 1.05, 1.084, 2.259, 4.287, 7.66, 18.584 ], "type": "pV", "using_tau_r": true }, "rhoL": { "T_r": 369.89, "Tmax": 369.8899999999991, "Tmin": 85.52500000000002, "description": "rho' = rhoc*(1+sum(n_i*theta^t_i))", "max_abserror_percentage": 0.4218642075006107, "n": [ 2.104068052280433, 0.3371892411622086, 0.4401223810964251, -3.5679018989260567, 59.93889697061387, -70.9402469085883 ], "reducing_value": 5000.000000000001, "t": [ 0.368, 0.875, 3.009, 9.51, 15.381, 17.001 ], "type": "rhoLnoexp", "using_tau_r": false }, "rhoV": { "T_r": 369.89, "Tmax": 369.8899999999991, "Tmin": 85.52500000000002, "description": "rho'' = rhoc*exp(Tc/T*sum(n_i*theta^t_i))", "max_abserror_percentage": 1.171965141592346, "n": [ -3.401360845132903, -1.9443653795380451, -0.4101211459709529, -15.598374206544214, 15.844867806184942, -15.298907422332046 ], "reducing_value": 5000.000000000001, "t": [ 0.431, 1.339, 2.091, 6.822, 8.214, 19.706 ], "type": "rhoV", "using_tau_r": true }, "sL": { "A": [ -309.43996740998193, 3.6685731329874827, -0.027209697955839388, 0.00014672536054570167, -5.29070080301745e-07, 1.1918175264093368e-09, -1.5161125579265272e-12, 8.276594148498385e-16 ], "B": [ 1, -0.0026415963884123058 ], "Tmax": 369.78999999999996, "Tmin": 85.525, "_note": "coefficients are in increasing order; 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T = c[0]*rho^3 + c[1]*rho^2 + c[2]*rho + c[3] with rho in mol/m^3 and T in K", "cL": [ 0.0, 0.0, -9.567201907483823e-06, 369.9378360095374 ], "cV": [ 0.0, 0.0, 9.857730275302854e-06, 369.8407113486235 ], "rhomolar_max": 5037.36296682965, "rhomolar_min": 4963.738199610669 }, "gas_constant": 8.314472, "gas_constant_units": "J/mol/K", "molar_mass": 0.04409562, "molar_mass_units": "kg/mol", "p_max": 1000000000, "p_max_units": "Pa", "pseudo_pure": false } ], "INFO": { "2DPNG_URL": "http://www.chemspider.com/ImagesHandler.ashx?id=6094", "ALIASES": [ "Propane", "propane", "R290", "C3H8", "PROPANE", "N-PROPANE", "NC3H8", "n-C3H8" ], "CAS": "74-98-6", "CHEMSPIDER_ID": 6094, "ENVIRONMENTAL": { "ASHRAE34": "A3", "FH": 4, "GWP100": 3.0, "GWP20": -1.0, "GWP500": -1.0, "HH": 1, "Name": "n-Propane", "ODP": -1.0, "PH": 0 }, "FORMULA": "C_{3}H_{8}", "INCHI_KEY": "ATUOYWHBWRKTHZ-UHFFFAOYSA-N", "INCHI_STRING": "InChI=1S/C3H8/c1-3-2/h3H2,1-2H3", "NAME": "n-Propane", "REFPROP_NAME": "PROPANE", "SMILES": "CCC" }, "STATES": { "critical": { "T": 369.89, "T_units": "K", "hmolar": 24483.449925262434, "hmolar_units": "J/mol", "p": 4251200.0, "p_units": "Pa", "rhomolar": 5000.000000000001, "rhomolar_units": "mol/m^3", "smolar": 90.46769877967495, "smolar_units": "J/mol/K" }, "triple_liquid": { "T": 85.525, "T_units": "K", "hmolar": -8671.12468936134, "hmolar_units": "J/mol", "p": 0.00017184840809308612, "p_units": "Pa", "rhomolar": 16625.805559650213, "rhomolar_units": "mol/m^3", "smolar": -61.55368255049795, "smolar_units": "J/mol/K" }, "triple_vapor": { "T": 85.525, "T_units": "K", "hmolar": 16150.334927009255, "hmolar_units": "J/mol", "p": 0.00017184840809308612, "p_units": "Pa", "rhomolar": 2.4194535056961567e-07, "rhomolar_units": "mol/m^3", "smolar": 228.67092565026866, "smolar_units": "J/mol/K" } }, "TRANSPORT": { "conductivity": { "BibTeX": "Marsh-JCED-2002", "critical": { "GAMMA": 0.0496, "R0": 1.03, "gamma": 1.239, "qD": 1395410494.88, "type": "simplified_Olchowy_Sengers", "zeta0": 1.94e-10 }, "dilute": { "A": [ -0.00124778, 0.00816371, 0.0199374 ], "B": [ 1.0 ], "T_reducing": 369.85, "T_reducing_units": "K", "m": [ 0 ], "n": [ 0, 1, 2 ], "type": "ratio_of_polynomials" }, "residual": { "B": [ -0.03695, 0.148658, -0.119986, 0.0412431, -0.00486905, 0.0482798, -0.135636, 0.117588, -0.0436911, 0.00616079 ], "T_reducing": 369.82, "T_reducing_units": "K", "d": [ 1, 2, 3, 4, 5, 1, 2, 3, 4, 5 ], "rhomass_reducing": 220.3, "rhomass_reducing_units": "kg/m^3", "t": [ 0, 0, 0, 0, 0, -1, -1, -1, -1, -1 ], "type": "polynomial" } }, "viscosity": { "BibTeX": "Vogel-JPCRD-1998", "dilute": { "C": 2.1357e-08, "a": [ 0.25104574, -0.47271238, 0.060836515 ], "molar_mass": 0.0440956, "molar_mass_units": "kg/mol", "t": [ 0, 1, 3 ], "type": "collision_integral" }, "epsilon_over_k": 263.88, "epsilon_over_k_units": "K", "higher_order": { "T_reduce": 369.825, "T_reduce_units": "K", "a": [ 3.59873030195e-05, -0.000180512188564, 8.77124888223e-05, -0.000105773052525, 0.000205319740877, -0.00012921093261, 5.89491587759e-05, -0.0001297400331, 7.66280419971e-05, -9.59407868475e-06, 2.10726986598e-05, -1.43971968187e-05 ], "d1": [ 2, 2, 2, 3, 3, 3, 4, 4, 4, 5, 5, 5 ], "d2": [ 1 ], "f": [ 0.00161688405374 ], "g": [ 2.50053938863, 2.1517543007382995 ], "gamma": [ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ], "h": [ 0, -0.5 ], "l": [ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ], "p": [ 1 ], "q": [ 0 ], "rhomolar_reduce": 5000, "rhomolar_reduce_units": "mol/m^3", "t1": [ 0, 1, 2, 0, 1, 2, 0, 1, 2, 0, 1, 2 ], "t2": [ 0 ], "type": "modified_Batschinski_Hildebrand" }, "initial_density": { "b": [ -19.572881, 219.73999, -1015.3226, 2471.01251, -3375.1717, 2491.6597, -787.26086, 14.085455, -0.34664158 ], "t": [ 0, -0.25, -0.5, -0.75, -1.0, -1.25, -1.5, -2.5, -5.5 ], "type": "Rainwater-Friend" }, "sigma_eta": 4.9748e-10, "sigma_eta_units": "m" } } }