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Chemkin-II: A Fortran Chemical Kinetics Package for the Analysis of Gas-Phase Chemical Kinetics.

DE90000917

Publication Date	1989
Personal Author	Kee, R. J.; Rupley, F. M.; Miller, J. A.
Page Count	132
Abstract	This document is the user's manual for the second-generation Chemkin package. Chemkin is a software package whose purpose is to facilitate the formation, solution, and interpretation of problems involving elementary gas-phase chemical kinetics. It provides an especially flexible and powerful tool for incorporating complex chemical kinetics into simulations of fluid dynamics. The package consists of two major software components: an Interpreter and Gas-Phase Subroutine Library. The Interpreter is a program that reads a symbolic description of an elementary, user-specified chemical reaction mechanism. One output from the Interpreter is a data file that forms a link to the Gas-Phase Subroutine Library. This library is a collection of about 100 highly modular Fortran subroutines that may be called to return information on equation of state, thermodynamic properties, and chemical production rates.
Keywords	Chemical Reactions Chemical Reaction Kinetics C Codes Computerized Simulation FORTRAN Manuals Thermodynamic Properties Computer applications ERDA/400201 ERDA/990220
Source Agency	Technical Information Center Oak Ridge Tennessee
NTIS Subject Category	99F - Physical & Theoretical Chemistry
Corporate Authors	Sandia National Labs., Livermore, CA.; Department of Energy, Washington, DC.
Document Type	Technical Report
NTIS Issue Number	199008
Contract Number	AC04-76DR00789

Chemkin-II: A Fortran Chemical Kinetics Package for the Analysis of Gas-Phase Chemical Kinetics.

Chemkin-II: A Fortran Chemical Kinetics Package for the Analysis of Gas-Phase Chemical Kinetics.
DE90000917

Publication Date	1989
Personal Author	Kee, R. J.; Rupley, F. M.; Miller, J. A.
Page Count	132
Abstract	This document is the user's manual for the second-generation Chemkin package. Chemkin is a software package whose purpose is to facilitate the formation, solution, and interpretation of problems involving elementary gas-phase chemical kinetics. It provides an especially flexible and powerful tool for incorporating complex chemical kinetics into simulations of fluid dynamics. The package consists of two major software components: an Interpreter and Gas-Phase Subroutine Library. The Interpreter is a program that reads a symbolic description of an elementary, user-specified chemical reaction mechanism. One output from the Interpreter is a data file that forms a link to the Gas-Phase Subroutine Library. This library is a collection of about 100 highly modular Fortran subroutines that may be called to return information on equation of state, thermodynamic properties, and chemical production rates.
Keywords	Chemical Reactions Chemical Reaction Kinetics C Codes Computerized Simulation FORTRAN Manuals Thermodynamic Properties Computer applications ERDA/400201 ERDA/990220
Source Agency	Technical Information Center Oak Ridge Tennessee
NTIS Subject Category	99F - Physical & Theoretical Chemistry
Corporate Authors	Sandia National Labs., Livermore, CA.; Department of Energy, Washington, DC.
Document Type	Technical Report
NTIS Issue Number	199008
Contract Number	AC04-76DR00789