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Author SHA1 Message Date
Scott Charlton
24dd7a116e
Update cmake.yml 
working on vars
 2021-09-14 22:16:01 -06:00
Charlton, Scott R
f51b62707c working on github dist 2021-09-14 22:12:33 -06:00
Charlton, Scott R
fe63ae8cb8 working on github dist 2021-09-14 22:04:54 -06:00
Charlton, Scott R
e55485529d working on github dist 2021-09-14 22:00:17 -06:00
Charlton, Scott R
e8ba3f51f5 working on github dist 2021-09-14 21:52:27 -06:00
Darth Vader
005f962eec Merge commit '60ad724c7a34fdd7a075e70da0e99a026d689bc2' 2021-09-08 14:36:16 +00:00
Darth Vader
60ad724c7a Merge commit 'e4bd9bafb40c82bff5ef275528ca3dd2836672e5' 2021-09-08 14:35:13 +00:00
Charlton, Scott R
e4bd9bafb4 [phreeqc3] fixes -Wclass-memaccess warnings for CRAN 2021-09-07 19:30:34 -07:00
Charlton, Scott R
ceb559b87f [iphreeqc] fix for CRAN (forwarding urls and DOI format) 2021-09-06 15:18:39 -06:00
Charlton, Scott R
59e9e4ea8e [iphreeqc] changed encoding from utf-8 to windows-1252 2021-09-01 15:11:45 -07:00
Charlton, Scott R
85425380ac Merge remote-tracking branch 'origin/master' 2021-08-31 18:46:41 -06:00
Charlton, Scott R
6666afd6c4 changed encoding from utf-8 to windows-1252 2021-08-31 18:45:34 -06:00
Darth Vader
ce1930963e Merge commit '33f5157d8b000ea2b29ff1eef64e57761723ea31' 2021-08-31 13:54:19 +00:00
Darth Vader
33f5157d8b Merge commit '29f06d269c189449f230e15761d01381cfd51de2' 2021-08-31 13:52:37 +00:00
Charlton, Scott R
29f06d269c fixed alignment in Description of solution 2021-08-31 07:47:49 -06:00
Darth Vader
4750442170 Merge commit 'ae41a1ffa67d7b4bf60373a164e24802cb7a1797' 2021-08-31 00:05:55 +00:00
Darth Vader
ae41a1ffa6 Merge commit '09a2680a6ec98cfd9d59e5b40b1594edfd6b4eff' 2021-08-31 00:04:03 +00:00
Charlton, Scott R
09a2680a6e guarded write_banner with NO_UTF8_ENCODING 2021-08-30 17:46:49 -06:00
Charlton, Scott R
082edbb51d changed src/print.cpp back to windows-1252 encoding; updated check_utf.sh 2021-08-30 17:36:40 -06:00
Darth Vader
8803451936 Merge commit 'fd78a499d084fc606f2df44065602e4017a895e0' 2021-08-27 16:06:26 +00:00
Darth Vader
fd78a499d0 Merge commit '8d7c1fce37a929778a2c34ee19c29933529f46bc' 2021-08-27 16:05:15 +00:00
Darth Vader
eb7983e6af Merge commit '1f963b6dc569c7c9b141da43a3d2b603920044af' 2021-08-27 16:04:17 +00:00
David Parkhurst
1f963b6dc5 new Basic functions 2021-08-25 21:11:09 -06:00
David Parkhurst
8d7c1fce37 adding mcd_Jtot and mcd_Jconc 2021-08-25 20:22:42 -06:00
David Parkhurst
9f0f6225cc Merge branch 'master' of github.com:usgs-coupled/phreeqc3 2021-08-25 20:16:20 -06:00
Darth Vader
97411317ee Merge commit '47a8b4e3d826313c9c42fd3e74472574fedb4b84' 2021-08-17 19:49:43 +00:00
Darth Vader
47a8b4e3d8 Merge commit '1040066da8c5dea10f0b29ece9e43082cd745fd8' 2021-08-17 19:48:47 +00:00
Charlton, Scott R
1040066da8 Merge remote-tracking branch 'usgs-coupled/master' 2021-08-17 13:44:03 -06:00
Charlton, Scott R
d19961bf85 Merge remote-tracking branch 'usgs-coupled/master' 2021-08-17 13:44:03 -06:00
Darth Vader
5752c54f20 Merge commit 'd4dfe590eb539c35219174adf5314480eebdf7f8' 2021-08-17 15:36:31 +00:00
Darth Vader
d4dfe590eb Merge commit '07a864d1a6ed582ddfae5e1c3bf5b0620c3dd75c' 2021-08-17 15:35:22 +00:00
Darth Vader
3ea6f629ef Merge commit '20e6e440f056358f9887ada878a76d8e3d4ecc64' 2021-08-17 15:34:36 +00:00
Darth Vader
782299dd16 Merge commit '5431417de7c0bf1cb07448a3db051671bc05c9ad' 2021-08-17 15:34:30 +00:00
David Parkhurst
2a9464430b cleaned up to eliminate some prints 2021-08-05 15:34:57 -06:00
David Parkhurst
5431417de7 noted changes for Peng-Robinson gases and Pitzer 2021-07-30 18:21:01 -06:00
David Parkhurst
07a864d1a6 all jacobians are consistent. Looks pretty good. 2021-07-17 12:21:02 -06:00
David Parkhurst
56975a7e0c Saved surface for numerical derivatives 2021-07-17 08:49:17 -06:00
David Parkhurst
df0d68b9d5 Runs all the test cases. Numerical derivatives work, but still some changes in residuals before and after jacobian calculations. 2021-07-16 22:27:03 -06:00
David Parkhurst
6bd936e0d7 Fixed numerical derivative (non-pitzer) 2021-07-15 20:37:58 -06:00
David Parkhurst
0dde2b010f removed comments 2021-07-15 11:44:28 -06:00
David Parkhurst
aef51fa3e6 Finally have derivatives right, I think 2021-07-15 11:38:17 -06:00
David Parkhurst
20281a0e7a always reset gases 2021-07-14 13:53:28 -06:00
David Parkhurst
13ec2fcd3e best I could do for H2S while maintaining old tests. Used INCREMENTAL reactions 2021-07-13 14:24:00 -06:00
David Parkhurst
8be1ba8327 revised jacobian_pz with new logic. Works with fixed_pressure examples H2S, H2S_pz, H2S_pz_appt, H2S_NaCl_Na2SO4. 2021-07-10 16:37:37 -06:00
David Parkhurst
20e6e440f0 still produces different residuals 2021-07-07 23:55:03 -06:00
David Parkhurst
71cf2a97b7 still produces different residuals 2021-07-07 23:55:03 -06:00
David Parkhurst
6ea9caf0f2 Tony H2S. Amm.dat, phreeqc.dat, pitzer.dat, utf8, updated test cases 2021-07-06 21:52:06 -06:00
David Parkhurst
9022ded877 Tony H2S. Amm.dat, phreeqc.dat, pitzer.dat, utf8, updated test cases 2021-07-06 21:52:06 -06:00
David Parkhurst
c1c97a8592 before H2S 2021-07-06 17:30:19 -06:00
David Parkhurst
a7be9fcfed Updated Amm.dat, phreeqc.dat, pitzer.dat for H2S(g) 2021-07-06 15:12:57 -06:00