10 Commits

Author	SHA1	Message	Date
Marco De Lucia	93088f9bf5	testing staged changes	2023-08-17 14:29:09 +02:00
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 Luebke	535ed489b3	fix: check of existence of objects in R setup list	2023-01-24 16:46:18 +01:00
Max Luebke	dc75c65b88	R: enable control of output after each iteration	2023-01-24 16:11:03 +01:00
Max Luebke	f7404110ab	fix: calculation of wp_sizes_vector	2023-01-24 16:11:01 +01:00
Max Luebke	dc036cfcee	fix: bring back old time and dt output to RDS file	2023-01-06 10:56:05 +01:00
Max Lübke	2c085faf45	refactor: cleanup R library	2022-11-10 16:06:11 +01:00
Max Lübke	28b59ff6c3	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	70c457f519	Added license header to all files	2021-02-09 17:58:23 +01:00
Max Lübke	51204cb5be	New Readme + moved R libraries to another folder	2021-02-08 13:50:19 +01:00