Started changing the dir structure to put one demo problem per directory

with a test answer.
2025-02-25 18:55:29 -06:00 · 2009-03-18 18:42:41 +00:00
parent 4b9aee1fb3
commit f8dca5d45e
10 changed files with 206 additions and 1 deletions
--- a/Cantera/python/examples/equilibrium/.cvsignore
+++ b/Cantera/python/examples/equilibrium/.cvsignore
@@ -2,3 +2,10 @@ Makefile
 ct2ctml.log
 h2o2.xml
 transport_log.xml
+KOH.xml
+adiabatic.csv
+cleanup
+equil_koh.csv
+graphite.xml
+gri30.xml
+.nfs*
--- a/Cantera/python/examples/equilibrium/adiabatic_flame/.cvsignore
+++ b/Cantera/python/examples/equilibrium/adiabatic_flame/.cvsignore
@@ -0,0 +1,9 @@
+Makefile
+runtest
+adiabatic.csv
+ct2ctml.log
+diff_csv.txt
+diff_out_0.txt
+graphite.xml
+gri30.xml
+output_0.txt
--- a/Cantera/python/examples/equilibrium/adiabatic_flame/Makefile.in
+++ b/Cantera/python/examples/equilibrium/adiabatic_flame/Makefile.in
@@ -0,0 +1,14 @@
+#!/bin/sh
+
+PYTHON_CMD = @PYTHON_CMD@
+
+run:
+	$(PYTHON_CMD) adiabatic.py
+
+test:
+	./runtest
+clean:
+	rm -f *.log *.csv *.xml
+
+# end of file
+
--- a/Cantera/python/examples/equilibrium/adiabatic_flame/adiabatic.py
+++ b/Cantera/python/examples/equilibrium/adiabatic_flame/adiabatic.py
--- a/Cantera/python/examples/equilibrium/adiabatic_flame/adiabatic_blessed_0.csv
+++ b/Cantera/python/examples/equilibrium/adiabatic_flame/adiabatic_blessed_0.csv
@@ -0,0 +1,51 @@
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+3.4346938775510205, 966.89295657625121, 0.44342933381998256, 6.9546790721397895e-10, 2.3753825979819607e-22, 1.3853137535974858e-23, 1.2144169402805007e-13, 0.045602114890655229, 7.8789658859578968e-27, 2.7022540681677016e-22, 3.5371264546968295e-31, 3.150721460042882e-27, 2.2508502342558412e-19, 1.0316174438380559e-21, 5.4326388039101444e-10, 0.020520833303144814, 0.19626095909250926, 0.033452591483614236, 4.3416401225585964e-12, 3.748347710378595e-08, 1.4699620416479182e-15, 3.1705927109942148e-18, 9.8627775070045958e-10, 3.2875352889513633e-24, 2.00271275340764e-10, 1.5620544967284273e-16, 7.5231376927641269e-08, 9.1991782858555304e-14, 1.2400786326696309e-07, 2.0398260770437068e-18, 2.3575160584589801e-10, 2.3711664934646972e-17, 3.6599796922365684e-23, 2.970833239681633e-19, 1.752175921360042e-13, 0.00012495933046277141, 1.6311775495143756e-16, 1.5050889034631559e-16, 7.2919361226638405e-29, 9.631270381536792e-21, 1.1185200468228628e-20, 3.7093817250300041e-19, 2.5736172724231444e-06, 2.5803167968008893e-15, 7.9234117241877172e-27, 3.234748720748818e-23, 1.9303376568730448e-13, 9.6412158405548623e-08, 7.297178872279946e-18, 0.58042076265400488, 0.0, 1.9635861132731275e-18, 2.8251888958332935e-12, 8.0889340621234411e-17, 1.3805476413980527e-10, 0.014893734031731999, 
+3.5, 963.98145438694462, 0.447012250348717, 6.4227532817227295e-10, 2.0242335036599579e-22, 1.216649706842515e-23, 1.1262128459186547e-13, 0.047289830461968704, 6.9249440935069105e-27, 2.5237367375075745e-22, 2.698401474975475e-31, 2.527815355544738e-27, 1.9611610475507212e-19, 8.865294639631431e-22, 5.219872814010732e-10, 0.021568610266140063, 0.19178208763014434, 0.034073805446120861, 4.0272834879916973e-12, 3.7014108355855665e-08, 1.4069404267082212e-15, 3.0032065446327364e-18, 1.0194485272571749e-09, 2.668119991798622e-24, 1.8551330476153141e-10, 1.4177907185176561e-16, 7.5378985222647032e-08, 9.0383794155393482e-14, 1.3222336871559322e-07, 1.7968312319527246e-18, 2.2723935599004977e-10, 2.1772876963171557e-17, 3.0520046241458623e-23, 2.6020643987583686e-19, 1.6422555621039005e-13, 0.00012882928407888263, 1.4852701967413977e-16, 1.3594538872154035e-16, 6.3094030003050488e-29, 8.7070024332602697e-21, 1.0102948163252022e-20, 3.1379619334090342e-19, 2.4554751332160721e-06, 2.369882654778628e-15, 6.6540183284642558e-27, 2.8485496861949139e-23, 1.8224924937571048e-13, 9.4689627995298474e-08, 6.4893473150280141e-18, 0.57750727494362697, 0.0, 1.96210613221939e-18, 3.0657300276590497e-12, 7.6318102144203021e-17, 1.4077626795423669e-10, 0.021389695954388898, 
--- a/Cantera/python/examples/equilibrium/adiabatic_flame/cleanup
+++ b/Cantera/python/examples/equilibrium/adiabatic_flame/cleanup
@@ -0,0 +1,5 @@
+#!/bin/sh
+#
+/bin/rm -rf equilibrate_log*.html
+/bin/rm -rf .cttmp* ct2ctml.log transport_log.xml vcs_equilibrate_res*.csv \
+            equil_koh.csv
--- a/Cantera/python/examples/equilibrium/adiabatic_flame/output_blessed_0.txt
+++ b/Cantera/python/examples/equilibrium/adiabatic_flame/output_blessed_0.txt
@@ -0,0 +1,51 @@
+At phi =          0.3, Tad =         1066
+At phi =       0.3653, Tad =         1208
+At phi =       0.4306, Tad =         1343
+At phi =       0.4959, Tad =         1472
+At phi =       0.5612, Tad =         1595
+At phi =       0.6265, Tad =         1713
+At phi =       0.6918, Tad =         1825
+At phi =       0.7571, Tad =         1931
+At phi =       0.8224, Tad =         2030
+At phi =       0.8878, Tad =         2119
+At phi =       0.9531, Tad =         2192
+At phi =        1.018, Tad =         2232
+At phi =        1.084, Tad =         2220
+At phi =        1.149, Tad =         2176
+At phi =        1.214, Tad =         2125
+At phi =         1.28, Tad =         2073
+At phi =        1.345, Tad =         2022
+At phi =         1.41, Tad =         1972
+At phi =        1.476, Tad =         1923
+At phi =        1.541, Tad =         1875
+At phi =        1.606, Tad =         1828
+At phi =        1.671, Tad =         1782
+At phi =        1.737, Tad =         1737
+At phi =        1.802, Tad =         1693
+At phi =        1.867, Tad =         1650
+At phi =        1.933, Tad =         1608
+At phi =        1.998, Tad =         1566
+At phi =        2.063, Tad =         1526
+At phi =        2.129, Tad =         1486
+At phi =        2.194, Tad =         1446
+At phi =        2.259, Tad =         1408
+At phi =        2.324, Tad =         1370
+At phi =         2.39, Tad =         1333
+At phi =        2.455, Tad =         1297
+At phi =         2.52, Tad =         1261
+At phi =        2.586, Tad =         1226
+At phi =        2.651, Tad =         1191
+At phi =        2.716, Tad =         1157
+At phi =        2.782, Tad =         1124
+At phi =        2.847, Tad =         1093
+At phi =        2.912, Tad =         1064
+At phi =        2.978, Tad =         1038
+At phi =        3.043, Tad =         1018
+At phi =        3.108, Tad =         1002
+At phi =        3.173, Tad =        989.5
+At phi =        3.239, Tad =        979.8
+At phi =        3.304, Tad =        972.9
+At phi =        3.369, Tad =        969.9
+At phi =        3.435, Tad =        966.9
+At phi =          3.5, Tad =          964
+output written to adiabatic.csv
--- a/Cantera/python/examples/equilibrium/adiabatic_flame/runtest.in
+++ b/Cantera/python/examples/equilibrium/adiabatic_flame/runtest.in
@@ -0,0 +1,63 @@
+#!/bin/sh
+#
+#
+temp_success="1"
+/bin/rm  -f output_0.txt  flamespeed.csv  diff_csv.txt diff_out_0.txt
+
+##########################################################################
+PYTHON_CMD=@PYTHON_CMD@
+prog=adiabatic.py
+if test ! -f $prog ; then
+   echo $prog ' does not exist'
+   exit -1
+fi
+#################################################################
+#
+CANTERA_DATA=${CANTERA_DATA:=../../../data/inputs}; export CANTERA_DATA
+CANTERA_BIN=${CANTERA_BIN:=../../../bin}
+
+#################################################################
+
+$PYTHON_CMD $prog  > output_0.txt <<+
+1.0
+
+retnStat=$?
+if [ $retnStat != "0" ]
+then
+  temp_success="0"
+  echo "$prog returned with bad status, $retnStat, check output"
+fi
+
+diff -w output_blessed_0.txt output_0.txt > diff_out_0.txt
+retnStat_0=$?
+
+csvdiff -a 1.0E-50 adiabatic_blessed_0.csv adiabatic.csv  > diff_csv.txt
+retnStat_csv_0=$?
+
+retnTotal=1
+if test $retnStat_0 = "0" 
+then
+  retnTotal=0
+fi
+
+retnCSVTotal=1
+if test $retnStat_csv_0 = "1" 
+then
+  retnCSVTotal=0
+fi
+
+if test $retnCSVTotal = "0"
+then
+  echo "Successful test comparison on "`pwd`
+    if test $retnTotal = "1"
+    then
+       echo "  But text files show differences see diff_out_0.txt"
+    fi
+else
+  echo "Unsuccessful test comparison on "`pwd` " test"
+  if test $retnTotal != "0"
+  then
+     echo "      files are different - see diff_test*.txt"
+  fi
+fi
+
--- a/Cantera/python/examples/equilibrium/cleanup
+++ b/Cantera/python/examples/equilibrium/cleanup
@@ -0,0 +1,5 @@
+#!/bin/sh
+#
+/bin/rm -rf equilibrate_log*.html
+/bin/rm -rf .cttmp* ct2ctml.log transport_log.xml vcs_equilibrate_res*.csv \
+            equil_koh.csv
--- a/Cantera/python/examples/equilibrium/multiphase_plasma.py
+++ b/Cantera/python/examples/equilibrium/multiphase_plasma.py
@@ -34,7 +34,7 @@ for n in range(100):
    # set the mixture to a state of chemical equilibrium holding
    # temperature and pressure fixed
    # mix.equilibrate("TP",maxsteps=10000,loglevel=1)
-    mix.vcs_equilibrate("TP",printLvl=1,maxsteps=10000,loglevel=1)
+    mix.vcs_equilibrate("TP",printLvl=0,maxsteps=10000,loglevel=0)
        
    # write out the moles of each species
    writeCSV(f,[t]+ list(mix.speciesMoles()))