MECHANISTIC MODELING OF HOMOGENEOUS REACTORS - A CHEMICAL COMPILER

被引:6
作者
ALRAN, D [1 ]
COME, GM [1 ]
CUNIN, PY [1 ]
GRIFFITHS, M [1 ]
机构
[1] INST NATL POLYTECH LORRAINE,CNRS,EQUIPE RECH 136,1 RUE GRANDVILLE,F-54042 NANCY,FRANCE
关键词
D O I
10.1016/0098-1354(79)80018-6
中图分类号
TP39 [计算机的应用];
学科分类号
081203 ; 0835 ;
摘要
A method for automatic processing of complex reaction mechanisms is described. A linear chemical notation has been defined, which needs only the standard available character set. The corresponding compiler accepts as entry a mechanism and its associated data, written in this language; it sets up tables of chemical species, reactions, numerical data and furnishes all the necessary informations for solving numerically the mathematical model of a reactor. A text editor allows the modification of the mechanism and associated data, in order to achieve model identification or simulation. © 1979.
引用
收藏
页码:87 / 89
页数:3
相关论文
共 2 条
[1]  
Edelson, A simulation language and compiler to aid computer solution of chemical kinetic problems., Computers & Chemistry, 1, pp. 29-33, (1976)
[2]  
Stabler, Chesick, A program system for computer integration of multistep reaction rate equations using the GEAR integrations method, International Journal of Chemical Kinetics, 10, pp. 461-469, (1978)