Parameter Estimation in a Simplified MWD Model for HDPE Produced by a Ziegler-Natta Catalyst

被引:62
作者
Thompson, Duncan E. [1 ]
McAuley, Kim B. [1 ]
McLellan, P. James [1 ]
机构
[1] Queens Univ, Dept Chem Engn, Kingston, ON K7L 3N6, Canada
关键词
estimability; modeling; molecular weight distribution; parameter estimation; Ziegler-Natta polymerization; MOLECULAR-WEIGHT DISTRIBUTIONS; METALLOCENE CATALYST; COPOLYMERIZATION; SELECTION;
D O I
10.1002/mren.200800052
中图分类号
TQ [化学工业];
学科分类号
0817 ;
摘要
A simplified steady-state model to predict MWDs of ethylene/butene and ethylene/hexene copolymers produced industrially using heterogeneous Z-N catalysts is developed. Estimability analysis is used to guide model simplification and to determine which parameters can be estimated using the available data. Scaling of response variables and parameters using information about their uncertainties ensures that appropriate results are obtained from the estimability analysis. Parameter estimates are obtained to provide good predictions of the measured MWDs. Although the parameter values obtained are specific to the Z-N catalyst of our industrial sponsor, the method should be useful for parameter estimation and model simplification in other catalytic polymerization systems.
引用
收藏
页码:160 / 177
页数:18
相关论文
共 13 条
[1]   Parameter set selection for estimation of nonlinear dynamic systems [J].
Chu, Yunfei ;
Hahn, Juergen .
AICHE JOURNAL, 2007, 53 (11) :2858-2870
[2]  
Kissin YV, 2001, J POLYM SCI POL CHEM, V39, P1681
[3]   Gas-phase ethylene/hexene copolymerization with metallocene catalyst in a laboratory-scale reactor [J].
Kou, B ;
McAuley, KB ;
Hsu, CC ;
Bacon, DW ;
Yao, KZ .
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2005, 44 (08) :2443-2450
[4]   Mathematical model and parameter estimation for gas-phase ethylene homopolymerization with supported metallocene catalyst [J].
Kou, B ;
McAuley, KB ;
Hsu, CC ;
Bacon, DW ;
Yao, KZ .
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2005, 44 (08) :2428-2442
[5]   Modeling of end-use properties of poly(propylene/ethylene) resins [J].
Latado, A ;
Embiruçu, M ;
Neto, AGM ;
Pinto, JC .
POLYMER TESTING, 2001, 20 (04) :419-439
[6]   Selection of model parameters for off-line parameter estimation [J].
Li, RJ ;
Henson, MA ;
Kurtz, MJ .
IEEE TRANSACTIONS ON CONTROL SYSTEMS TECHNOLOGY, 2004, 12 (03) :402-412
[7]   Parameter ranking by orthogonalization - Applied to nonlinear mechanistic models [J].
Lund, Berit Floor ;
Foss, Bjarne A. .
AUTOMATICA, 2008, 44 (01) :278-281
[8]   SOME NOTES ON MISSPECIFICATION IN MULTIPLE REGRESSIONS [J].
RAO, P .
AMERICAN STATISTICIAN, 1971, 25 (05) :37-&
[9]   CROSS-VALIDATORY CHOICE AND ASSESSMENT OF STATISTICAL PREDICTIONS [J].
STONE, M .
JOURNAL OF THE ROYAL STATISTICAL SOCIETY SERIES B-STATISTICAL METHODOLOGY, 1974, 36 (02) :111-147
[10]   Exploring reaction kinetics of a multi-site Ziegler-Natta catalyst using deconvolution of molecular weight distributions for ethylene-hexene copolymers [J].
Thompson, Duncan E. ;
McAuley, Kim B. ;
McLellan, P. James .
MACROMOLECULAR REACTION ENGINEERING, 2007, 1 (02) :264-274