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Analyzed about 10 hours ago. based on code collected about 14 hours ago.

Commit Message	Contributor	Files Modified	Lines Added	Lines Removed	Code Location	Date
Apr 23, 2023 — Apr 23, 2024 Showing page 1 of 3 Search / Filter on:
Added check that returned k(T,P) values are not negative.	Josh Allen	More...				over 13 years ago
Density of states can now be evaluated when E0 is just below the first grain.	Josh Allen	More...				over 13 years ago
Added ability to provide reaction path degeneracy in input files.	Josh Allen	More...				over 13 years ago
Added simulate module for directly solving the full and reduced ME.	Josh Allen	More...				over 13 years ago
Improved versions of the build scripts.	Josh Allen	More...				over 13 years ago
Added first version of theory guide.	Josh Allen	More...				over 13 years ago
Added logo and header to documentation.	Josh Allen	More...				over 13 years ago
Some updates to the developers' guide.	Josh Allen	More...				over 13 years ago
Some revisions to the users' guide.	Josh Allen	More...				over 13 years ago
Some refinements to the input file loading procedure.	Josh Allen	More...				over 13 years ago
Added capacity for generating full master equation matrix.	Josh Allen	More...				over 13 years ago
Tweaking of the order by which isomers are sorted during input file loading.	Josh Allen	More...				over 13 years ago
calculateRateCoefficients() now also returns time-independent vectors.	Josh Allen	More...				over 13 years ago
Added a number of checks to ensure the input file is complete.	Josh Allen	More...				over 13 years ago
Fixed minor error in recent fix of k(E) reverse rate determination.	Josh Allen	More...				over 13 years ago
Fixed bug in k(E) reverse rate determination.	Josh Allen	More...				over 13 years ago
When generating thermo from states, include E0 in the H298 calculation.	Josh Allen	More...				over 13 years ago
Now calculating equilibrium ratios from thermodynamics.	Josh Allen	More...				over 13 years ago
Merge branch 'cython'	Josh Allen	More...				over 13 years ago
Cythonized cse module (for chemically-significant eigenvalues method).	Josh Allen	More...				over 13 years ago
Added specialized convolve() method to reaction module.	Josh Allen	More...				over 13 years ago
convertFAME now can read RMG dictionary to get structure information.	Josh Allen	More...				over 13 years ago
Added reStructuredText documents for remainder of Developers' Guide.	Josh Allen	More...				over 13 years ago
Added/updated docstrings for many classes and methods.	Josh Allen	More...				over 13 years ago
Improvements to the collision module and its documentation.	Josh Allen	More...				over 13 years ago
Changed alpha parameter in SingleExponentialDownModel to power law.	Josh Allen	More...				over 13 years ago
Added acetyl + O2 example input file.	Josh Allen	More...				over 13 years ago
Can now specify bath gas as a mixture of species.	Josh Allen	More...				over 13 years ago
Added -o command-line flag for specifying the output file location.	Josh Allen	More...				over 13 years ago
Added missing spinMultiplicity to species writing to output file.	Josh Allen	More...				over 13 years ago

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