Adjoint-based sensitivity analysis of quantities of interest of complex combustion models

被引:31
作者
Lemke, Mathias [1 ]
Cai, Liming [2 ]
Reiss, Julius [1 ]
Pitsch, Heinz [2 ]
Sesterhenn, Joern [1 ]
机构
[1] Tech Univ Berlin, Inst Stromungsmech & Tech Akustik, Berlin, Germany
[2] Rhein Westfal TH Aachen, Inst Combust Technol, Aachen, Germany
关键词
complex reaction kinetics; sensitivity analysis; adjoint approach; GREENS-FUNCTION METHOD; CHEMICAL KINETIC SYSTEMS; DECOUPLED DIRECT METHOD; GAS-PHASE; N-HEPTANE; REDUCTION; IGNITION; KPP;
D O I
10.1080/13647830.2018.1495845
中图分类号
O414.1 [热力学];
学科分类号
摘要
An adjoint-based approach for the sensitivity analysis of complex reaction mechanisms is presented. It builds purely on the evaluation of the governing equations. No adjoint equations have to be derived explicitly. Instead, the required adjoint operator is constructed numerically. The approach can be utilised for various kinetic models and in existing codes with minimal implementation effort. All dependencies on the state and on model parameters are fully evaluated without simplifications. Sensitivities are calculated more efficiently and more robustly compared with the often-used brute-force method. The approach is demonstrated for a homogeneous (zero-dimensional) reactor with different complex reaction mechanisms including several reaction types.
引用
收藏
页码:180 / 196
页数:17
相关论文
共 34 条
[11]   FURTHER DEVELOPMENTS AND APPLICATIONS OF THE GREENS-FUNCTION METHOD OF SENSITIVITY ANALYSIS IN CHEMICAL-KINETICS [J].
DOUGHERTY, EP ;
HWANG, JT ;
RABITZ, H .
JOURNAL OF CHEMICAL PHYSICS, 1979, 71 (04) :1794-1808
[12]   The decoupled direct method for sensitivity analysis in a three-dimensional air quality model - Implementation, accuracy, and efficiency [J].
Dunker, AM ;
Yarwood, G ;
Ortmann, JP ;
Wilson, GM .
ENVIRONMENTAL SCIENCE & TECHNOLOGY, 2002, 36 (13) :2965-2976
[14]  
Duraisamy K, 2012, 42 AIAA FLUID DYN C
[15]   An introduction to the adjoint approach to design [J].
Giles, MB ;
Pierce, NA .
FLOW TURBULENCE AND COMBUSTION, 2000, 65 (3-4) :393-415
[16]  
Goodwin D.G., 2018, CANTERA OBJECT ORIEN, DOI 10.5281/zenodo.1174508
[17]   A compact shock-focusing geometry for detonation initiation: Experiments and adjoint-based variational data assimilation [J].
Gray, J. A. T. ;
Lemke, M. ;
Reiss, J. ;
Paschereit, C. O. ;
Sesterhenn, J. ;
Moeck, J. P. .
COMBUSTION AND FLAME, 2017, 183 :144-156
[18]   Evaluation of models for the low temperature combustion of alkanes through interpretation of pressure-temperature ignition diagrams [J].
Hughes, Kevin J. ;
Griffiths, John F. ;
Fairweather, Michael ;
Tomlin, Alison S. .
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2006, 8 (27) :3197-3210
[19]   GREENS FUNCTION METHOD OF SENSITIVITY ANALYSIS IN CHEMICAL-KINETICS [J].
HWANG, JT ;
DOUGHERTY, EP ;
RABITZ, S ;
RABITZ, H .
JOURNAL OF CHEMICAL PHYSICS, 1978, 69 (11) :5180-5191
[20]  
Jameson A., 1988, Journal of Scientific Computing, V3, P233, DOI 10.1007/BF01061285