Commit graph

5556 commits

Author SHA1 Message Date
Harry Moffat
748a4f20a6 Added some text to the output. 2006-07-07 16:31:52 +00:00
Harry Moffat
b94076538a Fixed a makefile error. 2006-07-07 00:34:41 +00:00
Harry Moffat
f53776f558 Fixed an error. 2006-07-07 00:33:52 +00:00
Harry Moffat
918710f495 Added additional test directories. 2006-07-07 00:28:49 +00:00
Harry Moffat
878e7cd19a Added the existing test for the DebyeHuckel object. 2006-07-07 00:28:16 +00:00
Harry Moffat
ea1e5cedb8 Added the DebyeHuckel object.
Note, this object needs a bit of work. It's not connected to the
real model of water yet.
2006-07-07 00:27:26 +00:00
Harry Moffat
9520238fb1 Added 2 tests with debugging turned on. 2006-07-06 21:54:16 +00:00
Harry Moffat
fd6141eddf Added the GvI test. 2006-07-06 21:13:39 +00:00
Harry Moffat
480829a8a7 Added the excess volume test. 2006-07-06 21:12:53 +00:00
Harry Moffat
ce87b6434c Added the Cp HMWSoln test. 2006-07-06 21:00:19 +00:00
Harry Moffat
f6f47c9d6b Added another test. 2006-07-06 20:13:38 +00:00
Harry Moffat
eb6b46ac47 Added directory. 2006-07-06 15:56:43 +00:00
Harry Moffat
1e197b2c50 Added unit test for HMWSoln. 2006-07-06 15:56:20 +00:00
Harry Moffat
b44ec59837 Added general .h define file 2006-07-06 15:41:15 +00:00
Harry Moffat
b5c1023aa8 Added a utility routine. 2006-07-06 15:40:07 +00:00
Harry Moffat
6aa9287438 Added Pitzer Object 2006-07-06 15:39:34 +00:00
Harry Moffat
4ca64eaccf Added another test directory makefile. 2006-07-05 21:25:55 +00:00
Harry Moffat
5448b36dc3 Added another test to add coverage to the ctml to xml treatment of
neg A coefficients.
2006-07-05 21:23:39 +00:00
Harry Moffat
b330040128 Added a couple of test directory Makefiles that were ommitted. 2006-07-05 14:35:02 +00:00
Harry Moffat
455c1249b4 Added a test for WaterTP 2006-07-04 01:11:35 +00:00
Harry Moffat
d311f84913 Added another test directory. 2006-07-04 01:04:42 +00:00
Harry Moffat
437d8d92de Added a test for WaterPDSS object. 2006-07-04 01:04:20 +00:00
Harry Moffat
a6294b4760 Added a couple more tests for electrochemistry. 2006-07-04 00:41:11 +00:00
Harry Moffat
f2e20a9218 Added another test. 2006-07-04 00:40:17 +00:00
Harry Moffat
d294f18177 Triple point calcultion test routine. 2006-07-04 00:39:45 +00:00
Harry Moffat
1f8fcc9cc4 Second test. 2006-07-04 00:32:12 +00:00
Harry Moffat
b6b3789a6f Added the first test for IAPWS 2006-07-04 00:21:28 +00:00
Harry Moffat
29bd558cc2 First commit of water properties routines. These are
under-the-hood routines for calculation of water electrolyte
thermochemistry.
2006-07-04 00:01:53 +00:00
Harry Moffat
e7615eca8b Added a new test directory. 2006-07-03 19:59:12 +00:00
Harry Moffat
89c62f458a Added a new test that captures negative A factors. 2006-07-03 19:58:43 +00:00
Harry Moffat
cdec1ffeee Added a new test. 2006-07-03 19:57:58 +00:00
Harry Moffat
71ef5ebfcc Fix for negative pre-exponential factors producing NaN rates
of progress. This bug was reported in the Cantera newsgroup.

The fix consists of replacing
  Rc = exp ( mlogA + blogT - Ea / RT)
with
  Rc = A * exp (b logT - Ea/RT)

Therefore, the log of A never has to be taken.

Note, this also allows for a zero rate of progress for a reaction.

Consequences:
   The permissible range of the rate constant values may be altered.
   Numerical roundoff differences will occur, since the order of
    operations in key rate constant evalulations has been changed.
   Speed of the calculation may be affected. I have no idea which way.

The fix should be considered as provisional. There are different pathways
for fixing this. This is merely the simplest.
2006-07-03 19:57:29 +00:00
Harry Moffat
228ebc78b1 Added a couple of comments. 2006-07-03 19:41:57 +00:00
Harry Moffat
201f6cceb5 python=minimal fixes on cygwin 2006-06-23 23:23:03 +00:00
Harry Moffat
0b8e0297bf Added gri30.xml, so this example will work under the none python option. 2006-06-23 21:04:30 +00:00
Harry Moffat
e99d457fba Fixed an error in the clean rule. 2006-06-23 21:01:27 +00:00
Harry Moffat
20a21103cb Doxygen fixes. 2006-06-23 20:35:16 +00:00
Harry Moffat
9a6b2185b3 Additions to doxygen documentation.
Fixes to doxygen docs -> eliminated all of the warnings and ommitted
 pages.
2006-06-23 20:33:44 +00:00
Harry Moffat
cfdd7d7293 Doxygen formatting changes. 2006-06-23 20:31:12 +00:00
Dave Goodwin
e778904e56 added C++ combustor example 2006-06-23 14:31:19 +00:00
Dave Goodwin
4c188f51b3 added combustor example 2006-06-23 14:28:53 +00:00
Harry Moffat
48285fbe21 Added frac.xml, since this is now a required file. 2006-06-22 15:10:10 +00:00
Harry Moffat
19b1def17f Fixed an error in figuring out what time stamp program, tscompare, works
on the current system.
2006-06-22 13:47:49 +00:00
Harry Moffat
07844d92f7 Added the diamond.xml file. It's now a prerequisite towards running
the problem.
2006-06-22 13:43:50 +00:00
Harry Moffat
664ba76fce Replaced silane.cti with silane.xml so that it will work for
python none installation.
2006-06-21 00:00:08 +00:00
Harry Moffat
93427d1f42 Commented out CANTERA_DATA statement. On the x86-linux1 cf machine, this
was causing the test to crash for some reason.
2006-06-20 23:52:32 +00:00
Harry Moffat
f4db5c279a Took out spurious output from the blessed file. 2006-06-20 23:16:03 +00:00
Harry Moffat
f1615cbdcd Took out a spurious print statement. 2006-06-20 23:15:08 +00:00
Harry Moffat
df9c0399ab Made this test work for python=none. 2006-06-20 23:11:06 +00:00
Harry Moffat
218535f66d Added a few directories:
min_python
2006-06-20 23:04:28 +00:00