11 Commits

Author	SHA1	Message	Date
Max Luebke	999ecac139	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 Luebke	0222aa8a72	fix: check of existence of objects in R setup list	2023-01-24 16:46:18 +01:00
Max Luebke	d15c84af58	R: enable control of output after each iteration	2023-01-24 16:11:03 +01:00
Max Luebke	76d9e0eb5a	fix: calculation of wp_sizes_vector	2023-01-24 16:11:01 +01:00
Max Luebke	f33ffbd82b	fix: bring back old time and dt output to RDS file	2023-01-06 10:56:05 +01:00
Max Lübke	756149c061	perf: remove unused R libraries/sources	2022-11-10 16:06:12 +01:00
Max Lübke	d40bad186d	refactor: cleanup R library	2022-11-10 16:06:11 +01:00
Max Lübke	871a2ec82a	BREAKING CHANGE: integrate 'tug' as diffusion module ... It is now possible to run a simulation for one iteration in sequential mode without the use of Rmufits. According scripts are provided. refactor: TransportSim renamed to DiffusionModule refactor: parsing of R input script is now done outside of simulation modules (except ChemSim)	2022-11-10 16:06:08 +01:00
Max Lübke	c223d9fd9a	added CMake install process + rearrange data dir	2021-02-09 20:02:03 +01:00
Max Lübke	4939decadd	Added license header to all files	2021-02-09 17:58:23 +01:00
Max Lübke	a8ae69b62d	New Readme + moved R libraries to another folder	2021-02-08 13:50:19 +01:00