14 Commits

Author SHA1 Message Date
Max Luebke
3fdf586e0d BREAKING CHANGE: use dump mechanism of PhreeqcRM-GFZ to get and set
internal variables

feat: enables exchange

data: added exchange only benchmark

data: applied required changes to benchmarks
2023-04-17 12:37:43 +02:00
Max Luebke
5c540af2bf build: add benchmarks to install target 2023-04-13 17:17:36 +02:00
Marco De Lucia
38abf31632 add bench/barite 2023-04-11 14:58:48 +02:00
Max Lübke
2020a25409 fix: converting to data frames substitutes special chars to '.' 2023-03-07 13:44:41 +01:00
Marco De Lucia
27b94065ea data: added surfex benchmark 2023-03-07 13:44:41 +01:00
Max Luebke
e6819b59bc BREAKING CHANGE: Introduce ChemistryModule as extension of PhreeqcRM 2023-03-07 13:44:41 +01:00
Max Luebke
74b1e466df build: add dolo_diffu_large to install list 2023-01-24 16:47:56 +01:00
Max Luebke
dc75c65b88 R: enable control of output after each iteration 2023-01-24 16:11:03 +01:00
Max Luebke
8ba796c178 data: adapt benchmarks to results of meeting 2023-01-24 16:11:03 +01:00
Marco De Lucia
080b2f99f2 MDL: suppressed warnings (hard coded for now); added 1k*2k simulation bench/dolo_diffu_inner_large 2023-01-24 16:10:08 +01:00
Max Lübke
e71369bcdf data: set signif vector and types 2023-01-24 16:10:08 +01:00
Max Lübke
5ef755744c build: install scripts under 'share/poet' 2023-01-24 16:10:08 +01:00
Marco De Lucia
4262e36947 Fixed filenames in dolo_diffu_inner 2023-01-24 16:10:08 +01:00
Marco De Lucia
57af37483f Added "bench" dir with dolo_diffu_inner 2023-01-24 16:10:08 +01:00