TChem

Software · Mon May 23 00:00:00 EDT 2011

DOI:https://doi.org/10.11578/dc.20171025.on.1056· OSTI ID:1823032 · Code ID:6172

The TChem toolkit is a software library that enables numerical simulations using complex chemistry and facilitates the analysis of detailed kinetic models. The toolkit provide capabilities for thermodynamic properties based on NASA polynomials and species production and consumption rates. It incorporates methods that can selectively modify reaction parameters for sensitivity analysis and uncertainty quantification. The library also contains several functions that provide analytically computed Jacobian matrices necessary for the efficient time advancement and analysis of detailed kinetic models.

• Short Name / Acronym: TCHEM v.0.1
• Project Type: Open Source, No Publicly Available Repository
• Site Accession Number: 4771
• Software Type: Scientific
• License(s): GNU Lesser General Public License v3.0
• Research Organization: Sandia National Laboratories (SNL), Albuquerque, NM, and Livermore, CA (United States)
• Sponsoring Organization: USDOE

  ---

  Primary Award/Contract Number:
  Other Award/Contract Number:

  AC04-94AL85000
• Code ID: 6172
• OSTI ID: 1823032
• Country of Origin: United States