INTEGRATION OF STIFF DIFFERENTIAL-EQUATIONS INCLUDING SENSITIVITY ANALYSIS BY LAPLACE-TRANSFORMATION

被引:5
作者
BERNDT, T
PICHT, R
SCHERZER, K
机构
来源
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS | 1991年 / 95卷 / 05期
关键词
CHEMICAL KINETICS; NUMERICAL METHODS; RADICALS;
D O I
10.1002/bbpc.19910950511
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
A new method has been developed to calculate analytical functions for the time-dependence of concentration and sensitivity coefficients based on a system of ODE by LAPLACE-transforms. The procedure is suitable for a special class of models containing first and second order steps. The usefulness of the method is demonstrated for the case of zinc dimethyl decomposition in toluene. Comparison with a conventional integration routine is made.
引用
收藏
页码:604 / 608
页数:5
相关论文
共 21 条
[1]  
BERNDT T, 1990, WISS Z TH MERSEBURG, V32, P685
[2]   EFFICIENT NUMERICAL-SIMULATION AND IDENTIFICATION OF LARGE CHEMICAL-REACTION SYSTEMS [J].
DEUFLHARD, P ;
NOWAK, U .
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1986, 90 (11) :940-946
[3]  
DOETSCH G, 1951, HDB LAPLACE TRANSFOR, V1
[4]  
Doetsch G, 1967, ANLEITUNG ZUM PRAKTI
[5]  
DOETSCH G, 1955, HDB LAPLACE TRANSFOR, V2
[6]  
Doetsch G., 1956, HDB LAPLACE TRANSFOR, VIII
[7]   HYDROGEN ABSTRACTION FROM TOLUENE BY METHYL RADICALS AND PRESSURE DEPENDENCE OF RECOMBINATION OF METHYL RADICALS [J].
DUNLOP, AN ;
KOMINAR, RJ ;
PRICE, SJW .
CANADIAN JOURNAL OF CHEMISTRY, 1970, 48 (08) :1269-&
[8]  
DUNLOP AN, 1970, CAN J CHEM, V48, P3205
[9]  
EBERT KH, 1981, MODELLING CHEM REACT
[10]  
Gear C.W, 1971, NUMERICAL INITIAL VA