{ "ANCILLARIES": { "hL": { "A": [ -683.5340858265819, -68.22406579479838, 15.24802918356051, -1.2299427355871255, 0.05852384695478586, -0.0016608248488005134, 2.5917542013291362e-05, -1.7252851306194313e-07 ], "B": [ 1, -0.02977469856834918 ], "Tmax": 33.045, "Tmin": 13.957, "_note": "coefficients are in increasing order; input in K, output in J/mol; value is enthalpy minus hs_anchor enthalpy", "max_abs_error": 2.0258314621948443, "max_abs_error_units": "J/mol", "type": "rational_polynomial" }, "hLV": { "A": [ 30.837327863662505, 247.4229577919716, -38.44404736581238, 3.0841781652989564, -0.14910034526062782, 0.004267658343433473, -6.682750468905388e-05, 4.4457792633659323e-07 ], "B": [ 1, -0.029750238752949784 ], "Tmax": 33.045, "Tmin": 13.957, "_note": "coefficients are in increasing order; input in K, output in J/mol; value is enthalpy minus hs_anchor enthalpy", "max_abs_error": 4.358855352767591, "max_abs_error_units": "J/mol", "type": "rational_polynomial" }, "melting_line": { "BibTeX": "Datchi-PRB-2000", "T_m": 14.009985, "parts": [ { "T_0": 1, "T_max": 700, "T_min": 13.957, "a": 231000.0, "c": 1.7627, "p_0": -236200.0 } ], "type": "Simon" }, "pS": { "T_r": 33.145, "Tmax": 33.144999999999925, "Tmin": 13.957000000000011, "description": "p'' = pc*exp(Tc/T*sum(n_i*theta^t_i))", "max_abserror_percentage": 0.006522036925715735, "n": [ -0.5553870929135406, -7.0852972599030295, 0.006868538454095541, 0.8295514415153659, -0.08773773693832483, 3.754274235303921 ], "reducing_value": 1296400.0, "t": [ 0.882, 1.072, 1.355, 2.61, 8.191, 1.239 ], "type": "pV", "using_tau_r": true }, "rhoL": { "T_r": 33.145, "Tmax": 33.144999999999925, "Tmin": 13.957000000000011, "description": "rho' = rhoc*(1+sum(n_i*theta^t_i))", "max_abserror_percentage": 0.8323321588331933, "n": [ 1.9546584452513824, -5.715534926385584, 714.2366728890577, -1666.5447521212081, 2698.8598951804593, -12755.576112629806 ], "reducing_value": 15508.0, "t": [ 0.407, 3.401, 7.095, 8.095, 10.911, 17.353 ], "type": "rhoLnoexp", "using_tau_r": false }, "rhoV": { "T_r": 33.145, "Tmax": 33.144999999999925, "Tmin": 13.957000000000011, "description": "rho'' = rhoc*exp(Tc/T*sum(n_i*theta^t_i))", "max_abserror_percentage": 0.5551328985772819, "n": [ -3.036644018774332, -773.9211864728516, 1530.809493601263, -3087.995404817007, 3472.491545729249, -15649.585518005188 ], "reducing_value": 15508.0, "t": [ 0.473, 6.618, 7.083, 9.094, 10.577, 19.579 ], "type": "rhoV", "using_tau_r": true }, "sL": { "A": [ -42.619377618476236, 1.6782134182261454, 0.13233311824399585, -0.017528808480858662, 0.0009821997092300948, -3.064618222163584e-05, 5.10847042332818e-07, -3.5720738493233e-09 ], "B": [ 1, -0.029776888177981797 ], "Tmax": 33.045, "Tmin": 13.957, "_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": [ 6.430433928390398e-12, -3.15824835274259e-07, 0.005156102359493002, 5.156196888181069 ], "cV": [ -5.225396958873852e-12, 2.274807134854265e-07, -0.0032854482527420407, 48.87593060548779 ], "rhomolar_max": 16106.075389591539, "rhomolar_min": 14901.511073260717 }, "gas_constant": 8.314472, "gas_constant_units": "J/mol/K", "molar_mass": 0.00201588, "molar_mass_units": "kg/mol", "p_max": 2000000000, "p_max_units": "Pa", "pseudo_pure": false } ], "INFO": { "2DPNG_URL": "http://www.chemspider.com/ImagesHandler.ashx?id=762", "ALIASES": [ "hydrogen", "HYDROGEN", "H2", "R702" ], "CAS": "1333-74-0", "CHEMSPIDER_ID": 762, "ENVIRONMENTAL": { "ASHRAE34": "A3", "FH": 4, "GWP100": -1.0, "GWP20": -1.0, "GWP500": -1.0, "HH": 0, "Name": "Hydrogen", "ODP": -1.0, "PH": 0 }, "FORMULA": "H_{2}", "INCHI_KEY": "UFHFLCQGNIYNRP-UHFFFAOYSA-N", "INCHI_STRING": "InChI=1S/H2/h1H", "NAME": "Hydrogen", "REFPROP_NAME": "HYDROGEN", "SMILES": "[HH]" }, "STATES": { "critical": { "T": 33.145, "T_units": "K", "hmolar": 601.0565562608032, "hmolar_units": "J/mol", "p": 1296400.0, "p_units": "Pa", "rhomolar": 15508.0, "rhomolar_units": "mol/m^3", "smolar": 19.44159905328063, "smolar_units": "J/mol/K" }, "triple_liquid": { "T": 13.957, "T_units": "K", "hmolar": -108.70835273182523, "hmolar_units": "J/mol", "p": 7357.828141607672, "p_units": "Pa", "rhomolar": 38198.54161031633, "rhomolar_units": "mol/m^3", "smolar": -6.193430589710146, "smolar_units": "J/mol/K" }, "triple_vapor": { "T": 13.957, "T_units": "K", "hmolar": 806.0017935109377, "hmolar_units": "J/mol", "p": 7357.828148402758, "p_units": "Pa", "rhomolar": 64.41526923322962, "rhomolar_units": "mol/m^3", "smolar": 59.34430288729439, "smolar_units": "J/mol/K" } }, "TRANSPORT": { "conductivity": { "BibTeX": "Assael-JPCRD-2011-Hydrogen", "critical": { "GAMMA": 0.052, "R0": 1.01, "gamma": 1.2415, "qD": 2500000000.0, "type": "simplified_Olchowy_Sengers", "zeta0": 1.5e-10 }, "dilute": { "A": [ -0.340976, 4.5882, -1.4508, 0.326394, 0.00316939, 0.000190592, -1.139e-06 ], "B": [ 138.497, -22.1878, 4.57151, 1.0 ], "T_reducing": 33.145, "T_reducing_units": "K", "m": [ 0, 1, 2, 3 ], "n": [ 0, 1, 2, 3, 4, 5, 6 ], "type": "ratio_of_polynomials" }, "residual": { "B": [ 0.0363081, 0.0018337, -0.0207629, -0.00886716, 0.031481, 0.015826, -0.0143097, -0.0106283, 0.0017498, 0.00280673 ], "T_reducing": 33.145, "T_reducing_units": "K", "d": [ 1, 1, 2, 2, 3, 3, 4, 4, 5, 5 ], "rhomass_reducing": 31.262, "rhomass_reducing_units": "kg/m^3", "t": [ 0, -1, 0, -1, 0, -1, 0, -1, 0, -1 ], "type": "polynomial" } }, "viscosity": { "BibTeX": "Muzny-JCED-2013", "dilute": { "C": 2.1357e-08, "a": [ 0.20963, -0.455274, 0.143602, -0.0335325, 0.00276981 ], "molar_mass": 0.00201588, "molar_mass_units": "kg/mol", "t": [ 0, 1, 2, 3, 4 ], "type": "collision_integral" }, "epsilon_over_k": 30.41, "epsilon_over_k_units": "K", "higher_order": { "hardcoded": "Hydrogen" }, "initial_density": { "b": [ -0.187, 2.4871, 3.7151, -11.0972, 9.0965, -3.8292, 0.5166 ], "t": [ 0, -1, -2, -3, -4, -5, -6 ], "type": "Rainwater-Friend" }, "sigma_eta": 2.97e-10, "sigma_eta_units": "m" } } }