ParameterUnits Data set Component ComponenComponenComponen

ACROLEIN WATER N2 O2
API 1 37.6558 10 340 340
CHARGE 1 0 0
DCPLS cal/mol-K 1 10.5115 10.1948
DGAQFM cal/mol 1 3917.07
DGAQHG cal/mol 1 4347 3954
DGFORM cal/mol 1 -15570 -54640 0 0
DGSFRM cal/mol 1 -56549.2
DHAQFM cal/mol 1 -2794.5
DHAQHG cal/mol 1 -2495 -2900
DHFORM cal/mol 1 -16940 -57800 0 0
DHSFRM cal/mol 1 -69962.7
DHVLB cal/mol 1 6770 9717 1333 1630
FREEZEPT C 1 -87.15 0.05 -209.85 -218.75
HCOM cal/mol 1 -371071 0 0 0
HFUS cal/mol 1 2436.23 1434.85 172.3 106.048
IONTYP 1 0 0
MUP debye 1 2.9 1.8 0 0
MW 1 56.0642 18.0153 28.0135 31.9988
OMEGA 1 0.33 0.344 0.04 0.021
OMEGHG cal/mol 1 -34680 -39430
PC bar 1 51.6758 220.483 33.9439 50.4599
RKTZRA 1 0.245675 0.243172 0.289129 0.288247
S25HG cal/mol-K 1 22.9 26.04
S025C cal/mol-K 1 26.488
S025E cal/mol-K 1 45.765 48.9985
SG 1 0.840169 1 0.3 0.3
TB C 1 52.85 100.05 -195.75 -182.95
TC C 1 232.85 374.15 -146.95 -118.55
TPT C 1 -87.66 0.01 -210.002 -218.789
VB cc/mol 1 70.3524 19.6361 34.7065 27.8734
VC cc/mol 1 190.086 55.8953 89.6408 73.3611
VLSTD cc/mol 1 66.7982 18.05 53.5578 53.5578
ZC 1 0.276942 0.229 0.29 0.288
ComponenComponenComponent ComponenComponenComponenComponenComponenComponenComponent
NH3 AN PROPANAL PROPI-01 ACRYL-01 ACETA H2 XYLOSE GLUCOSE
340 50.0011 47.7 49.8287 44.7744 48.9 340 -38.4743 -11.9371
0 0 0 0
6.06676 3857.21 6.72332 2.94297 4.58486 5.71057 1.64617 2.58E+12 30.165
-6329.42 4203.69
-6383 -32730 -33470 4236
-3860 25240 -31180 22980 46680 -31860 0 -166165 -204309
-176125 -216896
-19176.9 -1003.15
-19440 -57360 -50380 -1000
-10920 21000 -45900 12100 44200 -39760 0 -218783 -248655
-251027 -304122
5580 7500 6760 7710 7800 6150 216 19151.9 26171.5
-77.75 -43.85 -80.15 -92.85 -83.65 -122.95 -259.15 158.3 148.05
-75673.5 -284329 -402620 -430085 -403650 -263834 -57757.7 -507791 -606074
1350.7 1950.65 2051.68 1205.29 1488.37 551.734 27.9689 8570.05 7823.09
0 0
1.5 3.5 2.7 3.7 3.5 2.5 0 9.18986 2.7491
17.0306 41.0526 58.08 55.0794 53.0636 44.0532 2.01588 150.131 180.158
0.25 0.321 0.313 0.318 0.35 0.303 -0.22 0.846437 2.3867
-5000 -32420 -36860 -20900
112.775 48.332 47.6228 41.8472 45.5963 55.7288 12.9696 58.42 66.3137
0.246472 0.201664 0.247927 0.216969 0.222992 0.239958 0.320114 0.3224 0.31797
25.77 39.7 33 13.8
26.5835 13.7814
69.7011 122.25 89.6662 31.2124
0.3 0.787636 0.8029 0.786927 0.811777 0.7846 0.3 1.52109 1.18348
-33.45 81.65 47.85 97.35 77.35 20.45 -252.75 404.85 343.85
132.45 274.85 222.85 291.25 262.85 187.85 -239.95 682.55 825.85
-77.7 -43.95 -101.817 -92.741 -83.508 -123.356 -259.194 158.3 148.05
24.9078 57.9083 76.2167 78.9041 71.9552 56.6866 28.6127 130.31 204.631
72.3622 173.45 225.139 229.871 205.241 151.305 64.9115 343 490.382
53.5578 52.1755 72.5018 70.0659 65.4351 56.2823 53.5578 98.9485 152.61
0.242 0.184 0.26 0.205 0.21 0.22 0.305 0.252 0.318
Component