Ray Speth 5ad656e342 [ck2cti] Fix Chebyshev rate constant when using local quantity units ...

Since the leading Chebyshev coefficient has effective units like
log(cm^3/kmol), it needs to be converted directly to the default units of
the CTI file.

Analogous to the fix for PLOG reactions in #435.

2019-02-28 22:37:38 -05:00

..

air-no-reactions.cti

[CTI] Add optional 'note' field to Phase definitions

2013-12-05 20:54:08 +00:00

air-no-reactions.xml

[Transport] Make transport XML node optional

2015-04-22 14:08:24 -04:00

bad-troe.inp

[ck2cti] Detect badly formatted values of 4th Troe coefficient

2018-02-07 22:58:50 -05:00

BinarySolutionTabulatedThermo.cti

Remove execute bits from test data files

2019-02-22 09:17:20 -05:00

ch4_ion.cti

add test for O2- mix. diff.

2018-10-09 16:33:40 -04:00

chemically-activated-reaction.inp

[ck2cti] Translate "chemically activated" reactions

2013-07-06 21:44:10 +00:00

chemically-activated-reaction.xml

[Kinetics] Implement evaluation of "chemically activated" reaction rates

2013-07-06 21:44:02 +00:00

co2_RK_example.cti

Adding test coverage for ThermoPhase class RedlichKwongMFTP

2017-02-25 11:36:31 -05:00

co2_RK_lookup.cti

Adding test suite coverage for critcal property lookups in RedlichKwongMFTP

2018-12-11 11:08:47 -05:00

CombustorTest-integrateWithAdvance.csv

Add missing reaction to "h2o2" mechanism

2014-09-23 02:20:49 +00:00

CounterflowPremixedFlame-h2-mix.csv

[1D] Better initial grid for CounterflowPremixedFlame

2016-03-25 12:21:19 -04:00

custom-elements.inp

[ck2cti] Allow elements/isotopes with custom atomic weights

2016-06-22 20:22:58 -04:00

diamond_cvd.csv

[Python] Remove the legacy Python module

2013-12-09 01:35:08 +00:00

DiffusionFlameTest-h2-auto.csv

[1D] Try harder to find non-extinct diffusion flames when using 'auto'

2016-03-27 17:07:36 -04:00

DiffusionFlameTest-h2-mix-rad.csv

[1D] Add simple radiation model for flames

2015-01-15 21:15:15 +00:00

DiffusionFlameTest-h2-mix.csv

[Test/Cython/1D] Added a test for counterflow diffusion flames

2013-01-17 15:30:50 +00:00

dummy-thermo.dat

[ck2cti] Fix handling of thermo entries with end-of-line comments

2013-07-08 01:35:20 +00:00

duplicate-reactions.cti

[Kinetics] Fix duplicate reaction check to handle unchanged species

2017-08-02 16:46:24 -04:00

duplicate-species.inp

[ck2cti] Improve handling of duplicate species

2014-01-06 18:46:49 +00:00

duplicate-thermo.inp

[ck2cti] Check for duplicate thermo entries

2013-07-08 01:35:30 +00:00

equilibrium.cti

Added missing data for equilibrium tests

2012-04-16 20:59:54 +00:00

explicit-forward-order.inp

[Kinetics] Fix handling of integral, explicit reaction orders

2015-06-22 11:56:56 -04:00

explicit-forward-order.xml

[Kinetics] Fix handling of integral, explicit reaction orders

2015-06-22 11:56:56 -04:00

explicit-reverse-rate.inp

[ck2cti/Test] Add tests for explicit reverse reaction equal to zero

2016-11-25 18:18:38 -05:00

explicit-reverse-rate.xml

[ck2cti/Test] Add tests for explicit reverse reaction equal to zero

2016-11-25 18:18:38 -05:00

explicit-third-bodies.inp

[ck2cti] Preserve comments in the REACTIONS section

2014-09-24 23:17:44 +00:00

explicit-third-bodies.xml

[ck2cti] Added ability to convert falloff reactions with explicit third bodies

2013-01-11 22:56:05 +00:00

float-stoich.inp

[ck2cti] Allow stoichiometric coefficients ending in decimal points

2014-05-07 21:57:22 +00:00

frac.cti

[Kinetics] Check for negative and non-reactant reaction orders

2014-11-15 00:47:25 +00:00

frac.xml

[Kinetics] Check for negative and non-reactant reaction orders

2014-11-15 00:47:25 +00:00

gas-carbon-equil.csv

[Test] Add multiphase equilibrium tests based on 'adiabatic.py' example

2014-07-30 16:59:23 +00:00

gasNASA9.xml

[Test] Move NASA9poly test to GTest test suite

2014-09-24 23:18:01 +00:00

h2o2_emptyReactions.inp

[ck2cti/test] Add test for empty reaction section in CK input file

2014-07-17 15:36:53 +00:00

h2o2_missingElement.inp

ck2cti.py now checks for undefined elements

2012-07-26 20:48:49 +00:00

h2o2_missingThermo.inp

Added test to confirm that ck2cti.py detects missing thermo data

2012-07-26 20:49:06 +00:00

h2o2_unbalancedReaction.xml

Added a test where an unbalanced reaction is detected

2012-07-26 20:49:14 +00:00

h2o2-bad-geometry-tran.dat

Added data files needed for transport import tests

2012-08-29 22:32:47 +00:00

h2o2-duplicate-species-tran.dat

Added data files needed for transport import tests

2012-08-29 22:32:47 +00:00

h2o2-extra-column-entries-tran.dat

Separate transport data from comments in parseTransportData

2016-12-09 19:59:52 -05:00

h2o2-float-geometry-tran.dat

Handle bad representations of geometry flags

2017-06-14 17:39:52 -04:00

h2o2-missing-species-tran.dat

Added data files needed for transport import tests

2012-08-29 22:32:47 +00:00

h2o2-plus.xml

[1D] Fix save/restore when mechanism size differs

2013-07-18 00:04:13 +00:00

HMW_NaCl_sp1977_alt.xml

[SCons/Test] Regression tests also look for input files in test/data

2018-09-07 23:24:23 -04:00

invalid-equation.inp

[Input] Improve detection of invalid lines in reaction entries

2019-01-10 15:17:33 -05:00

invalid.cti

Add test to check that error messages from ctml_writer are propagated

2014-05-06 14:39:54 +00:00

kineticsfromscratch.cti

[Test] Fix reproducibility of values used in add_species_sequential test

2017-02-21 20:53:29 -05:00

koh-equil-HP.csv

[Test] Add more tests of the VCS equilibrium solver

2014-05-27 02:54:02 +00:00

koh-equil-TP.csv

[Test] Add more tests of the VCS equilibrium solver

2014-05-27 02:54:02 +00:00

LiFixed.xml

[Thermo] Allow species without thermo data

2019-01-23 16:43:44 -05:00

liquid-water.xml

[Thermo] Allow species without thermo data

2019-01-23 16:43:44 -05:00

MaskellSolidSolnPhase_nohmix.xml

Fix Issue 209.

2014-03-06 00:08:58 +00:00

MaskellSolidSolnPhase_valid.xml

Implement MaskellSolidSolnPhase::standardConcentrations() and getActivityConcentrations()

2014-03-06 22:30:19 +00:00

mock_ion.xml

[Thermo] Fix creation of IonsFromNeutralVPSSTP objects

2017-02-22 22:18:40 -05:00

NaCl_Solid.xml

[SCons/Test] Regression tests also look for input files in test/data

2018-09-07 23:24:23 -04:00

nasa9-test-subset.inp

[Input] Fix handling of skipped species in NASA9 input files

2019-01-10 15:17:33 -05:00

nasa9-test-subset.xml

[Input] Fix handling of skipped species in NASA9 input files

2019-01-10 15:17:33 -05:00

nasa9-test-therm.dat

[ck2cti] Fix conversion of NASA9 thermo with only one temperature range

2016-03-28 12:48:10 -04:00

nasa9-test.inp

Moved nasa9_reader test to Python

2012-07-26 20:49:26 +00:00

nasa9-test.xml

[ck2cti] Fix conversion of NASA9 thermo with only one temperature range

2016-03-28 12:48:10 -04:00

negative-order.cti

[test/ck2cti] Add tests for negative reaction orders

2017-12-02 19:18:59 -05:00

negative-order.inp

[test/ck2cti] Add tests for negative reaction orders

2017-12-02 19:18:59 -05:00

noninteger-atomicity.cti

[CTI] Allow non-integer atomicity

2014-06-06 00:18:13 +00:00

noxNeg.cti

[Test] Move "negATest" to GTest suite

2015-06-16 16:16:21 -04:00

noxNeg.xml

[Test] Move "negATest" to GTest suite

2015-06-16 16:16:21 -04:00

pdep-test.cti

[ck2cti] Fix Chebyshev rate constant when using local quantity units

2019-02-28 22:37:38 -05:00

pdep-test.inp

[ck2cti] Fix Chebyshev rate constant when using local quantity units

2019-02-28 22:37:38 -05:00

pdep-test.xml

[ck2cti] Fix Chebyshev rate constant when using local quantity units

2019-02-28 22:37:38 -05:00

photo-reaction.inp

[ck2cti] Handle reactions containing 'hv' pseudospecies

2015-10-05 14:59:35 -04:00

photo-reaction.xml

[ck2cti] Handle reactions containing 'hv' pseudospecies

2015-10-05 14:59:35 -04:00

ptcombust-motzwise.cti

Remove unnecessary reaction from ptcombust.cti

2016-07-28 22:38:05 -04:00

ptcombust-simple.cti

[1D/Test] Add test for ImpingingJet and ReactingSurface1D

2016-03-27 17:07:37 -04:00

reaction-orders.cti

[Kinetics] Check for non-existent species in reaction orders

2018-08-28 16:40:43 -04:00

RedlichKisterVPSSTP_valid.xml

Add RedlichKister tests and sample case for LiC6 electrode

2016-02-17 23:34:36 -05:00

simplephases.cti

[Test] Add some SpeciesThermoInterpType tests

2014-10-15 02:03:03 +00:00

sofc-test.csv

[Test] Add surface kinetics test based on the sofc.py example

2014-07-30 16:59:30 +00:00

sofc-test.xml

Fixes ConstDensityThermo::standardConcentration()

2017-12-06 10:57:15 -05:00

soot-therm.dat

[ck2cti] Add support for Chemkin-style extended elemental composition

2016-04-08 16:27:32 -04:00

soot.inp

[Cython] Move CTI/CTML converter tests from old Python module to Cython module

2013-12-09 01:34:50 +00:00

soot.xml

Moved ck2cti tests to the Python test suite

2012-07-26 20:49:18 +00:00

species-names.inp

[ck2cti] Fix over-zealous detection of section 'end' labels

2019-02-04 18:49:45 -05:00

sri-falloff.inp

[ck2cti] Add support for truncated section header names

2013-12-06 23:15:18 +00:00

sri-falloff.xml

Added test for converting "SRI" falloff functions from Chemkin input files

2012-08-17 16:42:43 +00:00

steam-reforming.cti

Added a few basic thermo tests to the Matlab unit tests

2012-03-23 22:16:28 +00:00

steam-reforming.xml

Added a few basic thermo tests to the Matlab unit tests

2012-03-23 22:16:28 +00:00

surface1-gas-noreac.inp

[ck2cti] Always write surface reactions to CTI file

2018-01-19 10:34:24 -05:00

surface1-gas.inp

[ck2cti] Add tests for surface mechanism conversion

2016-07-15 17:57:13 -04:00

surface1.inp

[ck2cti] Convert surface species with specific site occupancies

2017-08-22 00:29:35 -04:00

units-custom.inp

[ck2cti] Added support for the UNITS keyword

2013-01-11 22:56:25 +00:00

units-default.inp

[ck2cti] Added support for the UNITS keyword

2013-01-11 22:56:25 +00:00

unrecognized-section.inp

[Input] Improve error message for Chemkin files with unrecognized sections

2019-01-10 15:17:33 -05:00

unterminated-sections2.inp

[ck2cti] Fix for support of unterminated thermo sections

2014-01-06 18:47:02 +00:00

unterminated-sections.inp

[ck2cti] Add limited support for unterminated sections

2013-07-08 01:35:27 +00:00

WallKinetics-coverages-regression1.csv

[Reactor/Test] Added a regression test for reactor surface chemistry

2013-05-23 19:32:31 +00:00

WallKinetics-coverages-regression2.csv

[Reactor/Test] Added a regression test for reactor surface chemistry

2013-05-23 19:32:31 +00:00

WallTest-integrateWithAdvance.csv

Add missing reaction to "h2o2" mechanism

2014-09-23 02:20:49 +00:00

with-transport.inp

[ck2cti] Fix for mechanism files with in-line transport data

2013-07-08 01:35:23 +00:00