92 Commits

Author SHA1 Message Date
David L Parkhurst
f0c9564f15 latest examples
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7709 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2013-05-13 22:53:33 +00:00
David L Parkhurst
3c88e50ce0 source 7663
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7664 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2013-04-30 16:16:37 +00:00
David L Parkhurst
4cd1f689f1 7643 code
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7645 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2013-04-25 17:52:53 +00:00
Scott R Charlton
6ff403a6f0 added NOTICE to configure
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7404 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2013-01-30 04:52:41 +00:00
David L Parkhurst
63df8a4ba6 svn 7400 code base, latest mytest and examples
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7401 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2013-01-29 22:36:11 +00:00
Scott R Charlton
0ce73c598f updated for latest version
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7298 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2013-01-08 01:57:51 +00:00
Scott R Charlton
011b03da36 added bootstrap code to create doc/README and doc/RELEASE
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7291 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2013-01-04 23:32:59 +00:00
David L Parkhurst
5b76ea1d21 at svn 7264. Getting ready for distribution
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7265 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-31 20:27:14 +00:00
David L Parkhurst
4d2a272a69 Added ex15a.out and ex15b.out
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7264 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-31 19:56:16 +00:00
David L Parkhurst
5d66604480 Removed DATABASE definitions from 15, 17, and 20.
Modified Makefile accordingly.

Needed to simplify Win/test.bat

git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7241 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-20 01:49:38 +00:00
David L Parkhurst
74643748ad Updated makefiles for parallel testing.
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7236 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-19 17:21:15 +00:00
David L Parkhurst
234f998f06 Linux 64-bit on lobo02
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7234 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-19 01:08:56 +00:00
David L Parkhurst
3b6ccb6e07 Remove input files.
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7232 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-19 00:57:34 +00:00
David L Parkhurst
d90103c291 pc version of output
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7231 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-19 00:28:57 +00:00
David L Parkhurst
9432c8e9fc minor changes for manual.
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7195 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-13 17:14:34 +00:00
David L Parkhurst
2263323932 Kinniburgh found bug in surf_total.
Made a mistake when allowing redox states.
Added test case surf_check.out

Needed to checkin ex20b.

git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7161 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-05 00:26:28 +00:00
David L Parkhurst
25218036ff Set for initial HTO calculation
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7158 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-12-04 17:21:25 +00:00
David L Parkhurst
a9d21427db Updated for manual, mostly case for axes.
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7125 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-11-29 19:04:23 +00:00
David L Parkhurst
2f81f71ce0 Through example 10.
21 also updated.

git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7118 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-11-27 22:16:29 +00:00
Scott R Charlton
a062c70704 accidental checkin; reverted to 7084
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7113 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-11-27 06:32:43 +00:00
Scott R Charlton
8e8d7c0c3e working on configure
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7112 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-11-27 06:28:39 +00:00
David L Parkhurst
bbe1a44b39 new def removed for raw Gas Phase and Surface.
Latest examples run on Parkplace




git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7084 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-11-15 17:13:43 +00:00
David L Parkhurst
9f3afe9851 Checking in examples. All examples run,
however, mytest mu, sys_gas, and DanPhuong need to be fixed.

DanPhuong runs on Windows? 

sys_gas is problem with ah2o=0/1.

not sure about mu.


git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7074 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-11-09 23:41:10 +00:00
David L Parkhurst
b7b8fc71d1 Tony's changes, mostly -status 20121109
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7070 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-11-09 16:57:25 +00:00
David L Parkhurst
244dcf43bf Updating to Tony's latest
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@7069 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-11-09 16:55:23 +00:00
David L Parkhurst
2671345a70 Latest example output.
Latest Tony databases.

Removed statics.



git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6773 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-07-12 17:47:49 +00:00
David L Parkhurst
bf2176df96 updated ex21.
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6658 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-06-08 19:01:02 +00:00
David L Parkhurst
2f96cbf998 Tony's version
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6653 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-06-07 23:32:24 +00:00
David L Parkhurst
36ff0337e3 ex21
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6652 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-06-07 23:26:38 +00:00
David L Parkhurst
9288a4f528 git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6651 1feff8c3-07ed-0310-ac33-dd36852eb9cd 2012-06-07 23:24:31 +00:00
David L Parkhurst
875c783659 cap A, B, C for sub examples.
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6637 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-06-06 23:12:49 +00:00
David L Parkhurst
b7ab869a13 Tony changed the properties of water, I think in utilities.cpp
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6632 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-06-06 00:14:27 +00:00
David L Parkhurst
f06bcb47e5 Minor changes for manual.
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6626 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-06-01 22:36:20 +00:00
David L Parkhurst
049b488cf4 minor updates for manual
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6622 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-06-01 18:06:33 +00:00
David L Parkhurst
a48d816c6f Modified for manual
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6620 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-06-01 16:53:56 +00:00
David L Parkhurst
58ab5bce5c tsv updated in code.
ex2b updated.

through example 2 in examples.fm.

git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6616 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-31 22:44:48 +00:00
David L Parkhurst
dd42258fe4 renamed all data files for charts to .tsv
changed identifier to -plot_tsv_file in all input files.

git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6614 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-31 20:37:46 +00:00
David L Parkhurst
63b9ba5c47 ex3, ex12 ci
JohnsonCommentsReply.pdf

git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6606 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-31 00:26:37 +00:00
Scott R Charlton
b645d6b046 renamed ex19_meas.txt to ex19_meas.csv
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6605 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-30 20:58:48 +00:00
David L Parkhurst
f3cc5aacf4 ex2b and ex22 examples, co2.dat for ex22
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6571 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-18 17:12:11 +00:00
David L Parkhurst
436985c42a 2012-05-17, latest code, databases.
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6570 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-18 17:03:03 +00:00
David L Parkhurst
7b5afee35b Modified for new handling of surf related to phase.
Input files now have charge balanced formula.

Not checking cdmusic surfaces for surface master species as formula or
charge balanced surface master species.

deleted error.inp.



git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6553 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-02 20:04:50 +00:00
David L Parkhurst
9538528c56 run phreeqc3
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6549 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-01 19:49:58 +00:00
David L Parkhurst
56c4b8cade Latest examples and mytest
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6548 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-01 19:30:57 +00:00
David L Parkhurst
a68adf2525 Latest examples
header file for Linux PHRQ_io.cpp


git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6546 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-05-01 15:22:41 +00:00
Scott R Charlton
16342e4815 merged in http://internalbrr.cr.usgs.gov/svn_GW/phreeqcpp/branches/ErrorHandling 6269-6445
git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6446 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-04-11 02:21:16 +00:00
David L Parkhurst
0642749631 Merged ErrorHandling 6119-6268 changes.
All reactant structs have been removed.
Tony's pressure uses mu in pressure term of log_k.
Test cases run, discriminant check at 1e-8.

Still want to optimize out some k_temp calls and checks for same T, P, mu.

git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6269 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-03-06 23:42:49 +00:00
David L Parkhurst
b9e5edbdc7 memory initialization for cvode
Latest test cases without kinetics struct



git-svn-id: svn://136.177.114.72/svn_GW/phreeqcpp/branches/ErrorHandling@6089 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-01-20 18:45:13 +00:00
David L Parkhurst
46db385b2f Latest test cases after removing solid solution structures.
git-svn-id: svn://136.177.114.72/svn_GW/phreeqcpp/branches/ErrorHandling@6080 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-01-18 16:14:53 +00:00
David L Parkhurst
d291777d9d Fixed fp exceptions
renamed ss_assemblage
Fixed selected-output volume.


git-svn-id: svn://136.177.114.72/svn_GW/phreeqcpp/branches/ErrorHandling@6059 1feff8c3-07ed-0310-ac33-dd36852eb9cd
2012-01-12 21:13:44 +00:00