Initial estimates 206.799 37.560 24.791 BISECT FAILED Srt 0.01345 Gat 0.00614 Gbt 0.00000 Likelihood -1811.685 SSQ 81.725 AL -1893.410 Srt 0.00152 Gat 0.18767 Gbt 6.76733 Likelihood -2429.729 SSQ 305.222 AL -2734.950 Srt 0.00106 Gat 0.28836 Gbt 10.65065 Likelihood -2494.325 SSQ 425.032 AL -2919.358 Srt 0.00102 Gat 0.29926 Gbt 11.07477 Likelihood -2504.284 SSQ 451.108 AL -2955.392 Srt 0.00102 Gat 0.30011 Gbt 11.10790 Likelihood -2505.264 SSQ 457.783 AL -2963.047 Srt 0.00102 Gat 0.30018 Gbt 11.11041 Likelihood -2505.391 SSQ 459.249 AL -2964.641 Srt 0.00102 Gat 0.30018 Gbt 11.11060 Likelihood -2505.449 SSQ 459.608 AL -2965.057 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.481 SSQ 459.743 AL -2965.225 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.499 SSQ 459.821 AL -2965.320 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.508 SSQ 459.875 AL -2965.383 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.512 SSQ 459.913 AL -2965.426 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.514 SSQ 459.941 AL -2965.455 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.515 SSQ 459.960 AL -2965.475 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.516 SSQ 459.973 AL -2965.489 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.516 SSQ 459.982 AL -2965.498 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.516 SSQ 459.988 AL -2965.504 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.516 SSQ 459.992 AL -2965.508 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.516 SSQ 459.995 AL -2965.511 Srt 0.00102 Gat 0.30018 Gbt 11.11061 Likelihood -2505.516 SSQ 459.996 AL -2965.513 Data in minimization i NP Eq Q Qa Qb T X2 Sr Sa Sb Total pressure Ruff & Mugdan 1 7 F F F F 1542. 0.113 0.035 0.084 1.501 Wartenberg & Albrecht 2 16 F T T T 1555. 0.164 0.032 0.018 0.107 Fiock & Rodebush 3 9 F T T T 1279. 0.121 0.032 0.018 0.107 Deitz 4 9 F T F T 896. 0.111 0.032 0.190 0.107 Barton & Bloom 5 11 T T T T 1402. 0.141 0.032 0.018 0.107 Pugh & Barrow 6 137 T T T T 880. 0.553 0.032 0.018 0.107 Novikov & Polyachenok 7 9 F T T T 1295. 0.161 0.032 0.018 0.107 Schrier & Clark 8 31 T T T T 1300. 0.225 0.032 0.018 0.107 Kushkin et al 9 10 T F F F 1246. 0.098 0.030 0.060 0.924 Barchuk & Dubovoi 10 6 F T T F 1313. 0.144 0.032 0.018 0.472 Burylev & Mironov 11 10 T F F F 1423. 0.129 0.031 0.097 2.349 Knudsen effusion Deitz 12 6 F T F T 926. 0.026 0.032 0.256 0.107 Mayer & Wintner 13 5 F T T F 923. 0.034 0.032 0.018 1.203 Zimm & Mayer 14 21 F F F F 766. 0.708 0.092 0.059 0.298 Bradley & Volans 1 15 14 F T T T 782. 0.220 0.032 0.018 0.107 Bradley & Volans 2 16 7 F T T T 812. 0.120 0.032 0.018 0.107 Bradley & Volans 3 17 6 F T T T 826. 0.101 0.032 0.018 0.107 Miller & Kusch 18 10 F T F T 924. 0.107 0.032 0.399 0.107 Nesmeyanov & Sazonov 19 7 F T T F 810. 0.199 0.032 0.018 0.463 Ewing & Stern 20 24 F F F F 901. 0.201 0.021 0.107 0.495 Kawano & Kenpo 1 21 11 F F F F 775. 0.337 0.040 0.352 0.722 Kawano & Kenpo 2 22 11 F T F T 780. 0.314 0.032 0.316 0.107 Kawano & Kenpo 3 23 10 F T F T 774. 0.289 0.032 0.270 0.107 van der Kemp et al 24 17 F F F F 899. 0.173 0.155 0.027 1.901 Transpiration Naryshkin 25 3 F F F F 1102. 0.096 0.050 0.159 0.858 Treadwell & Werner 26 13 F F F F 933. 0.211 0.018 0.175 0.733 Barton & Bloom 27 7 F T T T 1385. 0.099 0.032 0.018 0.107 Schrier & Clark 28 10 F T T T 1274. 0.130 0.032 0.018 0.107 Murgulescu & Marta 29 23 F T T T 1422. 0.076 0.032 0.018 0.107 20:36:53 DelS1 133.03 Iteration 1 *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU WORK 0.0000068 18. 5.5 0.0000391 5. INFER = 1 IER = 0 206.779 37.779 24.884 Likelihood -2505.566 SSQ 459.946 AL -2965.513 Srt 0.00102 Gat 0.29693 Gbt 11.45718 Likelihood -2505.574 SSQ 460.073 AL -2965.646 Srt 0.00102 Gat 0.29693 Gbt 11.45715 Likelihood -2505.574 SSQ 460.004 AL -2965.578 Srt 0.00102 Gat 0.29693 Gbt 11.45715 Likelihood -2505.574 SSQ 459.997 AL -2965.571 Convergence 0.0135558258 20:36:54 DelS1 133.03 Iteration 2 *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU WORK 0.0000039 18. 6.1 0.0000391 5. INFER = 1 IER = 0 206.775 37.825 24.908 Likelihood -2505.575 SSQ 459.996 AL -2965.571 Srt 0.00102 Gat 0.29663 Gbt 11.51454 Likelihood -2505.575 SSQ 460.006 AL -2965.581 Srt 0.00102 Gat 0.29663 Gbt 11.51476 Likelihood -2505.575 SSQ 459.999 AL -2965.574 Convergence 0.00231864886 20:36:54 DelS1 133.03 Iteration 3 *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU WORK 0.0000018 21. 6.9 0.0000391 5. INFER = 1 IER = 0 206.775 37.834 24.913 Likelihood -2505.575 SSQ 459.999 AL -2965.574 Srt 0.00102 Gat 0.29659 Gbt 11.52441 Likelihood -2505.575 SSQ 460.000 AL -2965.575 Convergence 0.000433533177 The norm of the gradient 0.0000018 The number of function evaluation 21. The number of significant digits in parameters 6.9 The MARQUARDT scaling parameter 0.0000391 The number of iteration 5. INFER = 1 IER = 0 DelH1 DelH2 DelS2 206.775 37.834 24.913 Sum of squares 459.9997 Number of points 460 Average standard deviation 1.0044 LINV3P - IER 0 Parameter sqrt(Cii) 206.77 0.10 37.83 1.87 24.91 1.25 Correlation matrix 0.000 -0.732 0.000 -0.600 0.975 0.000 Data used in minimization i NP Eq Q Qa Qb T X2 Sr Sa Sb Total pressure Ruff & Mugdan 1 7 F F F F 1542. 0.113 0.035 0.084 1.496 Wartenberg & Albrecht 2 16 F T T T 1555. 0.164 0.032 0.017 0.108 Fiock & Rodebush 3 9 F T T T 1279. 0.121 0.032 0.017 0.108 Deitz 4 9 F T F T 896. 0.111 0.032 0.191 0.108 Barton & Bloom 5 11 T T T T 1402. 0.141 0.032 0.017 0.108 Pugh & Barrow 6 137 T T T T 880. 0.553 0.032 0.017 0.108 Novikov & Polyachenok 7 9 F T T T 1295. 0.161 0.032 0.017 0.108 Schrier & Clark 8 31 T T T T 1300. 0.225 0.032 0.017 0.108 Kushkin et al 9 10 T F F F 1246. 0.098 0.030 0.061 0.927 Barchuk & Dubovoi 10 6 F T T F 1313. 0.144 0.032 0.017 0.467 Burylev & Mironov 11 10 T F F F 1423. 0.129 0.031 0.097 2.345 Knudsen effusion Deitz 12 6 F T F T 926. 0.026 0.032 0.256 0.108 Mayer & Wintner 13 5 F T T F 923. 0.034 0.032 0.017 1.217 Zimm & Mayer 14 21 F F F F 766. 0.708 0.092 0.057 0.288 Bradley & Volans 1 15 14 F T T T 782. 0.220 0.032 0.017 0.108 Bradley & Volans 2 16 7 F T T T 812. 0.120 0.032 0.017 0.108 Bradley & Volans 3 17 6 F T T T 826. 0.101 0.032 0.017 0.108 Miller & Kusch 18 10 F T F T 924. 0.107 0.032 0.399 0.108 Nesmeyanov & Sazonov 19 7 F T T F 810. 0.199 0.032 0.017 0.451 Ewing & Stern 20 24 F F F F 901. 0.201 0.021 0.107 0.507 Kawano & Kenpo 1 21 11 F F F F 775. 0.337 0.040 0.353 0.712 Kawano & Kenpo 2 22 11 F T F T 780. 0.314 0.032 0.318 0.108 Kawano & Kenpo 3 23 10 F T F T 774. 0.289 0.032 0.272 0.108 van der Kemp et al 24 17 F F F F 899. 0.173 0.155 0.027 1.913 Transpiration Naryshkin 25 3 F F F F 1102. 0.096 0.050 0.162 0.861 Treadwell & Werner 26 13 F F F F 933. 0.211 0.018 0.173 0.720 Barton & Bloom 27 7 F T T T 1385. 0.099 0.032 0.017 0.108 Schrier & Clark 28 10 F T T T 1274. 0.130 0.032 0.017 0.108 Murgulescu & Marta 29 23 F T T T 1422. 0.076 0.032 0.017 0.108 ********************************************** ********************************************** 20:36:54 DelS1 133.53 *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU WORK 0.0000040 29. 6.4 0.0000118 6. INFER = 1 IER = 0 207.174 36.712 23.357 The norm of the gradient 0.0000040 The number of function evaluation 29. The number of significant digits in parameters 6.4 The MARQUARDT scaling parameter 0.0000118 The number of iteration 6. INFER = 1 IER = 0 DelH1 DelH2 DelS2 207.174 36.712 23.357 Sum of squares 461.0144 Number of points 460 Average standard deviation 1.0055 20:36:54 DelS1 132.53 *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU *** UNDEFINED ERROR (IER = 0) FROM IMSL ROUTINE UEETLU WORK 0.0000069 31. 6.5 0.0000039 8. INFER = 1 IER = 0 206.378 38.823 26.338 The norm of the gradient 0.0000069 The number of function evaluation 31. The number of significant digits in parameters 6.5 The MARQUARDT scaling parameter 0.0000039 The number of iteration 8. INFER = 1 IER = 0 DelH1 DelH2 DelS2 206.378 38.823 26.338 Sum of squares 460.9561 Number of points 460 Average standard deviation 1.0054