Program: Kintecus - Model various chemical kinetics simulations

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More Info. Program: Kintecus

Industrial Strength/Research Grade chemical modelling, chemical kinetics and equilibrium software for simulation of combustion, nuclear, biological, enzyme, atmospheric and many other processes via a graphical interface.Kintecus features the ability to run Chemkin/SENKIN II/III models without the use of supercomputing power or FORTRAN compiling/linking. Multiple Chemkin/freestyle thermodynamic databases can be used. Isothermal/Non-isothermal, adiabatic constant volume, constant pressure (variable volume) can be modelled with a flick of a switch. Programmed volume (replicating engine piston motion), programmed temperature, programmed species concentration can all be included in your model WITHOUT C/FORTRAN programming. Heterogeneous chemistry is also modelled. Now can now fit or optimise rate constants, initial concentrations, Lindemann/Troe/SRI/LT parameters, enhanced third body factors, initial temperature, residence time, energy of activation and many other parameters against your experimental/fabricated dataset(s). Kintecus has the ability to fit/optimise rate constants, initial concentrations, Lindemann/Troe/SRI/LT parameters, enhanced third body factors, initial temperature, residence time, energy of activation and many other parameters against your dataset(s). Note that Kintecus will actually fit the parameters at EXACTLY the time your data was measured with confidence bands/uncertainty analysis. Unlike other programs, Kintecus DOES NOT interpolate a function against your data and then fit the values against this interpolation. There is no need to “clean” your data, suggest interpolation methods nor specify timing meshes against your experimental data since Kintecus calculates values at exactly the times you specify in your experimental datafile .Can also scan parameters and bootstrap standard errors as well as perform metabolic control analysis via eigenvector/eigenvalue analysis.

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