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50 Commits

Author SHA1 Message Date
Ingmar Schoegl
845a551277 Replace vector_fp 2023-08-05 16:26:32 -04:00
Ray Speth
23ebd13dbf Deprecate XML-era transport names 'Mix' and 'Multi' 
Fixes #1425
 2023-03-13 22:58:24 -05:00
Ingmar Schoegl
5cd3d8a29a [test_problems] Remove checks for legacy VS versions 
_MSC_VER < 1900 corresponds to 1800 and earlier, which is
VC++ version 12.0 (Visual Studio 2013). Cantera now uses the C++17
standard, with the current minimum requirement VC++ version 14.1
(Visual Studio 2017).
 2023-03-10 13:39:22 -06:00
Ray Speth
6d2760b76c [Transport] Fix evaluation of delta-star polynomials 
Some polynomial coefficients were fit to 6th order polynomial but only
evaluated as 5th order polynomials, using the first 6 coefficients of
the 7 fitted coefficients. This changes the evaluation to use all of
the fitted coefficients.

Fixes #1070
 2021-10-19 21:50:18 -04:00
Ray Speth
e0b3823c10 [Test] Replace XML with YAML input for additional test_problems tests 2021-06-19 16:11:26 -06:00
Raymond Speth
89818bffa6 Remove excess includes from header files 2021-02-21 17:38:15 -05:00
Ingmar Schoegl
91c7bf14d7 [Base] finalize introduction of Solution object in C++ layer 2019-11-08 15:12:36 -05:00
Ingmar Schoegl
2a9554c134 [Base] consolidate shared_ptr access in Solution 2019-11-08 15:12:36 -05:00
Ingmar Schoegl
a0350925a7 [test_problems] replace convenience wrapper classes by C++ Solution 
- Remove dependence on IdealGasMix.h
 2019-11-08 15:12:36 -05:00
Ray Speth
8bcb62f727 Fix GRI3.0 transport coefficients 
The old (C++) ck2cti program unnecessarily rounded some species transport
coefficients. This updates the coefficients in the input files derived from GRI
3.0, and updates the test comparisons for affected tests.
 2019-02-25 11:05:40 -05:00
Ray Speth
14b9454819 [C++] Clean up of top-level headers 
These headers should only include general functionality, i.e. base classes and
factory methods. Users working directly with derived types can include the
relevant headers directly.

Deprecate some top-level headers which are not really useful.
 2016-05-14 16:10:10 -04:00
Ray Speth
0647823ada Replace DATA_PTR macro with calls to data() 2015-10-17 18:58:50 -04:00
Ray Speth
5ed6d9a2af [Test] Fix compilation errors with VS2015 2015-09-08 12:26:58 -04:00
Ray Speth
6cc5652de6 Remove commented-out code 2015-07-20 17:20:46 -04:00
Ray Speth
d308944509 [Test] Remove unused, platform-specific 'runtest' scripts 2015-07-15 12:17:11 -04:00
Ray Speth
c7ba8bfb84 Remove abandoned autotools build system 2014-03-04 17:38:53 +00:00
Ray Speth
d253fc0d63 Eliminate redundant standard library includes 2013-06-05 17:08:13 +00:00
Ray Speth
bf727c2631 Removed redundant copies of some input files 2012-08-08 22:18:24 +00:00
Ray Speth
88bb6fe679 Removed obsolete C++ Chemkin mechanism converter 2012-07-26 20:49:50 +00:00
Nicholas Malaya
c9acf2a5d3 [cantera]: lowering precision requirements in several tests 2012-07-17 15:50:35 +00:00
Nicholas Malaya
532141a107 [cantera2.0]: adding missing -lexecstream -pthread to makefile.am in tests 2012-06-19 02:06:23 +00:00
Nicholas Malaya
43660e4c0c [cantera2.0]: all tests now compile, from makefile.am modifications 2012-06-18 16:42:46 +00:00
Ray Speth
16da33ad42 Fixed compiler warnings in the test suite 2012-05-25 23:13:30 +00:00
Ray Speth
d16f70ab44 Fixed some spelling issues 2012-04-04 18:44:24 +00:00
Ray Speth
54efbaa320 Rewrote exception handling to be more general and more explicit 
CanteraError inerits from std:exception, so now it has a what() method
that is used to print a message describing the exception. Adding an
exception to the Cantera error stack now requires explicitly calling
the .save() method.
 2012-03-05 20:45:56 +00:00
Ray Speth
16e82a3ab0 Remove unused definitions of the function pAtable from test_problems 2012-02-22 00:17:30 +00:00
Ray Speth
30d233474a Use std::min and std::max instead of preprocessor macros 2012-02-21 16:03:09 +00:00
Ray Speth
0b8d2ec223 Removed includes of Cantera.h from the regression tests 2012-02-15 01:00:46 +00:00
Ray Speth
1bffc6e150 Fix include paths for tests and samples 2012-02-12 02:47:21 +00:00
Ray Speth
a6f939c2fe Applied consistent formatting to all C++ code 
Done using astyle:
astyle --style=kr --add-brackets --indent=spaces=4 --indent-col1-comments --unpad-paren --pad-header --align-pointer=type --lineend=linux
 2012-02-10 17:24:00 +00:00
Ray Speth
75db210a43 Merge branch 'pecos_autotools' into 'trunk' 
This merge skips some of the source tree rearrangement from the
autotools branch, so the autotools build system is not presently
working.

Conflicts:
	Cantera/cxx/include/kinetics.h
	Cantera/cxx/include/zerodim.h
	Cantera/cxx/src/Cantera.h
	Cantera/cxx/src/importPhase.cpp
	Cantera/cxx/src/importPhase.h
	Cantera/cxx/src/thermo.h
	Cantera/cxx/src/transport.h
	Cantera/ext/f2c_libs/arith.hwin32
	Cantera/ext/f2c_libs/arithchk.c
	Cantera/ext/f2c_libs/ftell64_.c
	Cantera/ext/f2c_libs/pow_qq.c
	Cantera/ext/f2c_libs/qbitbits.c
	Cantera/ext/f2c_libs/qbitshft.c
	Cantera/ext/f2c_math/mkl_cblas.h
	Cantera/ext/f2c_recipes/Makefile.in
	Cantera/ext/f2c_recipes/simp1.c
	Cantera/ext/f2c_recipes/simp2.c
	Cantera/ext/f2c_recipes/simp3.c
	Cantera/ext/f2c_recipes/simplx.c
	Cantera/ext/f2c_recipes/splie2.c
	Cantera/ext/f2c_recipes/splin2.c
	Cantera/ext/f2c_recipes/spline.c
	Cantera/ext/f2c_recipes/splint.c
	Cantera/ext/recipes/Makefile.in
	Cantera/ext/recipes/simp1.f
	Cantera/ext/recipes/simp2.f
	Cantera/ext/recipes/simp3.f
	Cantera/ext/recipes/simplx.f
	Cantera/ext/recipes/splie2.f
	Cantera/ext/recipes/splin2.f
	Cantera/ext/recipes/spline.f
	Cantera/ext/recipes/splint.f
	Cantera/ext/tpx/CMakeLists.txt
	Cantera/ext/tpx/ideal.cpp
	Cantera/ext/tpx/lkw.cpp
	Cantera/ext/tpx/lkw.h
	Cantera/src/base/config.h.in
	Cantera/src/converters/ck2ctml.cpp
	Cantera/src/converters/ck2ctml.h
	Cantera/src/numerics/NonlinearSolver.cpp
	Cantera/src/numerics/ctlapack.h
	Cantera/src/numerics/sort.cpp
	ChangeLog
	License.rtf
	docs/install_examples/cygwin_gcc344_f2c_numeric.sh
	docs/install_examples/linux.64_sierra_gcc444_python264_numpy
	docs/install_examples/linux_rhel5_64_gcc424_dbg_python264_numpy
	docs/install_examples/sol10_64bit_CC57_py24_numarray
	examples/cxx/flame1.cpp
	ext/f2c_libs/arithchk.c
	ext/f2c_libs/arithchk/arithchk.c
	ext/math/gmres.h
	test_problems/ChemEquil_gri_pairs/runtest
	test_problems/ChemEquil_ionizedGas/runtest
	test_problems/ChemEquil_red1/basopt_red1.cpp
	test_problems/VCSnonideal/NaCl_equil/Makefile.in
	test_problems/VPsilane_test/runtest
	test_problems/cathermo/DH_graph_1/runtest
	test_problems/cathermo/DH_graph_NM/runtest
	test_problems/cathermo/DH_graph_Pitzer/runtest
	test_problems/cathermo/DH_graph_acommon/runtest
	test_problems/cathermo/DH_graph_bdotak/runtest
	test_problems/cathermo/HMW_dupl_test/runtest
	test_problems/cathermo/HMW_graph_GvI/HMW_graph_GvI.cpp
	test_problems/cathermo/HMW_graph_GvT/HMW_graph_GvT.cpp
	test_problems/cathermo/VPissp/runtest
	test_problems/cathermo/ims/runtest
	test_problems/cathermo/issp/runtest
	test_problems/cathermo/stoichSubSSTP/runtest
	test_problems/cathermo/testIAPWS/runtest
	test_problems/cathermo/testIAPWSPres/runtest
	test_problems/cathermo/testIAPWSTripP/runtest
	test_problems/cathermo/testWaterPDSS/runtest
	test_problems/cathermo/testWaterTP/runtest
	test_problems/cathermo/wtWater/runtest
	test_problems/cxx_ex/equil_example1.cpp
	test_problems/cxx_ex/examples.cpp
	test_problems/cxx_ex/kinetics_example1.cpp
	test_problems/cxx_ex/kinetics_example2.cpp
	test_problems/cxx_ex/kinetics_example3.cpp
	test_problems/cxx_ex/rxnpath_example1.cpp
	test_problems/cxx_ex/transport_example1.cpp
	test_problems/cxx_ex/transport_example2.cpp
	test_problems/mixGasTransport/runtest
	test_problems/nasa9_reader/runtest
	test_problems/negATest/runtest
	test_problems/printUtilUnitTest/runtest
	test_problems/pureFluidTest/runtest
	test_problems/rankine_democxx/runtest
	test_problems/silane_equil/runtest
	test_problems/surfSolverTest/runtest
	test_problems/surfSolverTest/runtest2
	test_problems/surfkin/runtest
	tools/testtools/Makefile.in
 2012-02-10 16:22:02 +00:00
Nicholas Malaya
26f81ad26a [cantera]: adding multigastransport test 2012-02-07 16:47:30 +00:00
Nicholas Malaya
35c088a406 [cantera]: removing all these makefile.in's 2012-02-07 16:43:23 +00:00
Ray Speth
d832f32625 Eliminated the Cantera_CXX namespace 2012-01-23 03:35:46 +00:00
Ray Speth
b88846e5e0 Fixed C++ tests that were failing under Windows 
Visual Studio defaults to 3-digit exponents when printing in scientific
notation. The tests now use a MSVC-specific function to change this
behavior when necessary.
 2012-01-09 17:35:28 +00:00
Ray Speth
71588d307d Remove files for Autotools and Visual Studio build systems 2011-12-14 19:38:10 +00:00
Harry Moffat
201117842e ignore list maintenance. 2009-07-29 15:22:58 +00:00
Harry Moffat
9091de5aa3 Added PURIFY instrumentation commands to a lot of test programs. 2008-12-30 22:08:14 +00:00
Harry Moffat
2f259c6f6a Worked on making the Makefiles more uniform 2008-05-06 23:32:07 +00:00
Harry Moffat
6ded74a26d Added using namespace command 2008-02-16 21:48:00 +00:00
Harry Moffat
c22dfbd9c2 Added a test against build_with_f2c 
Took out src_dir_tree checks
 2008-01-15 16:54:27 +00:00
Harry Moffat
696c9bcd39 Added .depends to the make all rule. 2007-12-19 17:00:13 +00:00
Harry Moffat
0535ba5982 Changed some formatting to 4 digits from 5. I was having trouble with 
the last digit changing.
 2007-12-19 16:50:02 +00:00
Dave Goodwin
783ea0a254 *** empty log message *** 2007-12-19 04:29:50 +00:00
Harry Moffat
f46c9da1cd Rebaselined -> changed in 5th dig due to new constants 2007-12-17 20:25:36 +00:00
Harry Moffat
d8bb6b7fd2 Fixed a couple of errors in the Makefiles. 
Special cased lapack and blas, and took out a recursive variable defn.
 2007-10-29 23:50:09 +00:00
Dave Goodwin
707bea68da *** empty log message *** 2007-10-29 14:01:42 +00:00
Harry Moffat
a85279c015 Cutoff low values so that comparisons pass between machines 2007-09-12 22:02:08 +00:00
Harry Moffat
6f0ef653b0 Improved the dependencies in the file. 2007-08-29 20:48:50 +00:00
Harry Moffat
6469863f62 Addition of basic test for multiTransport object. 
This just picks an arbitrary condition, calculates all of the
interfacial properties, and dumps it to an ascii file.
We want to ensure that the answer doesn't change over time.
 2007-07-31 21:04:58 +00:00