Ray Speth
81cf00260d
[ck2cti] Add support for species names containing '+' and '='
2013-12-06 23:15:24 +00:00
Ray Speth
a69d56ab28
[ck2cti] Check for duplicate thermo entries
...
By default, raise an exception.
With '--permissive', use the first entry found.
2013-07-08 01:35:30 +00:00
Ray Speth
5d26a264f4
[ck2cti] Add limited support for unterminated sections
...
Each section of the input file should end with 'END'. Other utilities that work
with these files don't always require this, so we allow unterminated sections
if the '--permissive' flag is used, otherwise these are considered errors.
2013-07-08 01:35:27 +00:00
Ray Speth
812ec6ef77
[ck2cti] Fix for mechanism files with in-line transport data
2013-07-08 01:35:23 +00:00
Ray Speth
f1e5183431
[ck2cti] Fix to allow species names starting with special characters
2013-07-08 01:35:15 +00:00
Ray Speth
08724c9ac3
[ck2cti] Translate "chemically activated" reactions
...
These are reactions with an additional set of Arrhenius parameters labeled
'HIGH' in the input file. They may also have a set of falloff function
parameters.
2013-07-06 21:44:10 +00:00
Ray Speth
9631f44d29
[Python] Fixed some more incompatibilities with Python 2.6
2013-05-24 20:14:14 +00:00
Ray Speth
7430e11aa5
[Test] Fixed regression in Python 2.6 support
...
Support for the implcit handling of positional arguments with "{}" isn't
available until Python 2.7.
2013-05-24 17:47:24 +00:00
Ray Speth
5d353c1ad4
[Test] Improved messages generated by chemkinConverterTest
2013-04-24 21:47:10 +00:00
Ray Speth
183af676d5
[ck2cti] Added support for the UNITS keyword
2013-01-11 22:56:25 +00:00
Ray Speth
da67bc122c
[Test] Refactored to eliminate repeated code in ck2cti tests
2013-01-11 22:56:19 +00:00
Ray Speth
8ae3ca5a17
[ck2cti] Refactored to add class Parser and remove global variables
2013-01-11 22:56:16 +00:00
Ray Speth
60d44997e0
[ck2cti] Added '--permissive' flag to ignore certain errors
2013-01-11 22:56:12 +00:00
Ray Speth
994acf84ea
[ck2cti] Added ability to convert falloff reactions with explicit third bodies
...
For reactions written as: R1+R2(+S1)=P1(+S1), the implication is that
the third-body efficiencies for all colliders besides S1 are zero.
2013-01-11 22:56:05 +00:00
Ray Speth
c0f2734719
Added tests for converting chemkin-format transport data with ck2cti.py
...
Includes tests that check to make sure the converter detects duplicate and
missing species.
2012-08-29 18:30:58 +00:00
Ray Speth
f23c4fa940
Added a test for handling of explicit reaction orders in Chemkin input files
2012-08-17 16:43:02 +00:00
Ray Speth
7a327abb16
Added test for handling of explicit reverse rate constants in Chemkin input files
2012-08-17 16:42:53 +00:00
Ray Speth
eb9441182d
Added test for converting "SRI" falloff functions from Chemkin input files
2012-08-17 16:42:43 +00:00
Ray Speth
4e0fea7079
Added a test for converting Chebyshev and P-log reactions with ck2cti.py
2012-07-26 20:50:23 +00:00
Ray Speth
7472136e44
Converter tests now check some kinetics parameters
2012-07-26 20:49:33 +00:00
Ray Speth
9801b03a50
Moved nasa9_reader test to Python
2012-07-26 20:49:26 +00:00
Ray Speth
13e188381d
Moved ck2cti tests to the Python test suite
2012-07-26 20:49:18 +00:00
Ray Speth
db57f3a200
Added test to confirm that ck2cti.py detects missing thermo data
2012-07-26 20:49:06 +00:00
Ray Speth
0e21bfd0e0
Introduced a test suite for Chemkin-format mechanism conversions
2012-07-26 20:49:01 +00:00
