9 Commits

Author	SHA1	Message	Date
Max Lübke	480dd146f4	BREAKING CHANGE: Enable Surface/Exchange using new API of PhreeqcEngine	2024-05-06 10:01:57 +00:00
Max Luebke	0c2597d97f	feat: introduce LookupKey and rounding schemes ... feat: implement data clustering using PHT feat: implement interpolation refactor: use named vector for DHT species definition and significant digits data: remove unusable input scripts data: move Phreeqc database to benchmark dir refactor: rename dolomite benchmark directory refactor: remove DHT prop type from input script	2023-08-01 18:34:50 +02:00
Max Lübke	f9da7830f2	fix: re-enable DHT correctly ... feat: store excess H and O instead of total values	2023-04-24 16:58:48 +02:00
Marco De Lucia	5429696d89	Adding scheme to README	2023-01-24 16:10:08 +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
Marco De Lucia	57af37483f	Added "bench" dir with dolo_diffu_inner	2023-01-24 16:10:08 +01:00
Max Lübke	1d37709e98	util: provide conversion of new rounding scheme in ReadDHT	2023-01-24 16:10:08 +01:00
Marco De Lucia	a3bd0cef6d	refactor: apply changes from MDL	2023-01-06 10:56:05 +01:00
Max Lübke	edc0733ae4	Split files into subdirectories	2020-11-18 14:36:07 +01:00