22 Commits

Author SHA1 Message Date
Max Lübke
c046e907b4 WIP: fix solution heterogeneity 2024-10-16 14:59:24 +02:00
Max Luebke
ee940d20e4 Improve usability outside POET 2024-10-16 14:43:01 +02:00
Max Luebke
e3c3e890df refactor: Enable std::map::contains only when cpp >= 20 is defined 2024-09-10 18:09:51 +02:00
Max Lübke
6fd2e96411 refactor: Update C++ standard to c++20 in IPhreeqcPOET target 2024-09-10 09:11:28 +02:00
Max Lübke
324810368e feat: remove header dependency to c++20 features 2024-09-10 09:11:13 +02:00
Max Lübke
bd1cbceb2c Merge branch 'ml/kinetic-names' into 'poet'
refactor: Comment out unused code in KineticWrapper::names(), leading to name duplication

See merge request naaice/iphreeqc!8
2024-08-29 08:46:47 +02:00
Max Lübke
48e65d87ad refactor: Comment out unused code in KineticWrapper::names(), leading to doubling of names 2024-08-29 08:25:14 +02:00
Max Luebke
674ac498a9 Set C++23 standard for IPhreeqcPOET target 2024-08-26 11:19:58 +02:00
Max Lübke
e6e5e0d515 fix: Add missing "H" and "O" primaries 2024-05-07 09:52:22 +00:00
Max Lübke
9ef1111a39 Update Documentation 2024-05-06 09:53:13 +00:00
Max Luebke
8bdbb7bf6b BREAKING CHANGE: Add wrappers for reactants to get/set values 2024-05-06 09:53:00 +00:00
Max Luebke
c645eea842 Add getSolutionNames() method to IPhreeqcPOET.hpp 2024-04-03 12:28:08 +00:00
Max Luebke
a554c3fa4f Fix reset of cell queue pointer 2024-04-03 10:45:41 +00:00
Max Luebke
3e43e0e6db Fix cell copy functionality in constructor 2024-04-02 11:33:14 +00:00
Max Lübke
f695619875 Add queueCell, dequeueCells, runQueuedCells, setCell, and getCell methods 2024-03-28 14:23:05 +00:00
Max Lübke
d6e7130746 Update IPhreeqcPOET constructor to use LoadDatabaseString and RunString methods 2024-03-19 13:11:33 +00:00
Max Lübke
b34c327377 Refactor getModuleSizes method and remove commented code 2024-03-19 08:57:53 +00:00
Max Luebke
d92ab31765 Refactor API 2024-03-18 23:05:59 +01:00
Max Luebke
54136c8e0c Add module sizes 2024-03-13 23:49:57 +01:00
Max Luebke
f3f86bb4ac Add raw_dumps() function to IPhreeqcPOET.hpp 2024-03-13 16:55:00 +01:00
Max Luebke
9cb2aba57a Add SolutionMapping struct and related methods to IPhreeqc and IPhreeqcPOET classes 2024-03-09 23:51:15 +01:00
Max Lübke
1a644baaba Add poet library and related files 2024-03-08 15:27:52 +01:00