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Author	SHA1	Message	Date
Marco De Lucia	3b47b8ac1f	Update README: qs2 as default output format, gfz.de everywhere	2024-12-20 09:21:16 +01:00
Marco De Lucia	0437670e05	Less and more informative stdout messages	2024-12-20 09:21:16 +01:00
Marco De Lucia	9f89edd492	Added qs2 as new default format	2024-12-20 09:21:15 +01:00
Max Lübke	347b60c3f3	Merge branch 'ml/gitlab-ci' into 'main' ... Refactor CI pipeline by removing the build stage and adjusting test job dependencies See merge request naaice/poet!47	2024-12-20 09:06:18 +01:00
Max Lübke	c36fe346b3	Refactor CI pipeline by removing the build stage and adjusting test job dependencies	2024-12-20 09:04:30 +01:00
Max Lübke	f4f4ea2be2	Merge branch 'ml/fix-license' into 'main' ... Revert "No code changes made." See merge request naaice/poet!46	2024-12-20 09:00:27 +01:00
Max Lübke	60c4a15c9f	Update LICENSE to include updated copyright notice and additional guidelines for program distribution	2024-12-20 08:58:40 +01:00
Max Lübke	0c22f17df7	Revert "No code changes made." ... This reverts commit f60b7cf7fcb33e9ff55e1c8050775217d9d37f1a.	2024-12-20 08:57:51 +01:00
Max Lübke	824442b315	Merge branch 'ml/fix-license' into 'main' ... Fix license parsing error of GitLab? See merge request naaice/poet!45	2024-12-20 08:55:43 +01:00
Max Lübke	f60b7cf7fc	No code changes made.	2024-12-20 08:46:51 +01:00
Max Lübke	d121585894	Merge branch 'mdl/fgcsbench' into 'main' ... Mdl/fgcsbench See merge request naaice/poet!43	2024-12-13 12:19:57 +01:00
Marco De Lucia	03385d3caf	reverting <format> since gcc < 13 does not support it	2024-12-13 12:14:55 +01:00
Marco De Lucia	2478518d73	Update references to .qs2 in README	2024-12-13 12:14:55 +01:00
Marco De Lucia	9a787b793b	Update README: qs2 as default output format, gfz.de everywhere	2024-12-13 12:14:55 +01:00
Marco De Lucia	a519edd102	Less and more informative stdout messages	2024-12-13 12:14:55 +01:00
Marco De Lucia	61d3a8a227	Added qs2 as new default format	2024-12-13 12:14:55 +01:00
Hannes Martin Signer	b29be5fd6d	Merge branch 'update-scheme' into 'main' ... update poet scheme See merge request naaice/poet!42	2024-12-10 15:03:54 +01:00
Hannes Martin Signer	b19cdef894	Update 2 files ... - /docs/POET_scheme.svg - /docs/POET.drawio	2024-12-10 15:02:45 +01:00
Max Lübke	b67c1fd36d	Merge branch 'update-poet-scheme' into 'main' ... update POET scheme See merge request naaice/poet!41	2024-12-10 11:15:48 +01:00
Hannes Martin Signer	2dba14d3bd	update POET scheme	2024-12-10 11:14:01 +01:00
Max Lübke	5c92a2156f	Merge branch 'ml/iphreeqc-v0.3' into 'main' ... Update IPhreeqc Submodule to v0.3 See merge request naaice/poet!40	2024-12-04 11:35:27 +01:00
Max Lübke	6c660557fd	refactor: Replace PhreeqcEngine instances with PhreeqcRunner for improved chemistry processing	2024-12-04 10:34:13 +00:00
Max Lübke	db7a2ad2ce	build: Enhance Dockerfile for improved environment setup and dependency management	2024-12-04 08:44:55 +00:00
Max Lübke	0d9162fb66	Merge branch 'ml/misc' into 'main' ... Various changes to build files (CMake & devcontainer) See merge request naaice/poet!38	2024-11-07 20:57:45 +01:00
Max Lübke	716454e115	build: Update Dockerfile and devcontainer.json for enhanced environment setup	2024-11-07 19:56:04 +00:00
Max Lübke	287eda880a	build: Refactor R runtime detection in CMake to ensure required parameters are set	2024-11-07 19:56:04 +00:00
Max Lübke	66098aab40	Merge branch 'ml/new-iphreeqc-api' into 'main' ... Update to IPhreeqc v3.8.2 See merge request naaice/poet!37	2024-11-07 14:23:58 +01:00
Max Lübke	cdbf344329	fix: Update getSolutionNames call to remove unnecessary argument	2024-11-07 14:22:58 +01:00
Max Lübke	45ea77ae0f	Update subproject commit in ext/iphreeqc	2024-11-07 14:22:51 +01:00
Marco De Lucia	eec7123001	Merge branch 'delucia-readme-patch-68839' into 'main' ... Fix: README.md See merge request naaice/poet!36	2024-09-26 11:47:46 +02:00
Marco De Lucia	6316c43094	Update README.md	2024-09-26 11:45:07 +02:00
Marco De Lucia	54b54efa0f	Merge branch 'mdl/qs-rebased' into 'main' ... rebased mdl/enable-qs to merge with main See merge request naaice/poet!34	2024-09-16 13:07:43 +02:00
Max Luebke	c0fe7d2a4e	fix: Corrected log10 calculation in master_iteration_end function	2024-09-16 12:05:19 +02:00
Max Luebke	0f6ff06c4a	feat: use CLI11 as argument parser ... feat: improve poet_initializer	2024-09-16 11:57:00 +02:00
Marco De Lucia	1e14ba6d69	fixed damn source_R	2024-09-12 16:15:21 +02:00
Marco De Lucia	91cf9658d2	cosmetic fixes in DiffusionInit.cpp	2024-09-12 14:57:11 +02:00
Marco De Lucia	deb3d1884d	fix: removed Time-stamp lines from README and CMake/	2024-09-12 14:56:42 +02:00
Marco De Lucia	63a4918313	fix: removed all Time-stamp lines from src/	2024-09-12 14:56:09 +02:00
Marco De Lucia	492172c26f	fixing stuff and adding comments	2024-09-12 14:54:05 +02:00
Marco De Lucia	fc7a78be54	Fixes in README and poet.cpp	2024-09-12 14:53:58 +02:00
Marco De Lucia	25937ec5fd	Update README.md	2024-09-12 14:51:44 +02:00
Max Lübke	962f6dbbdd	refactor: Rework deferred R function evaluation ... applied commit fix: Unique pointer behaviour of `global_rt_setup` was messed up	2024-09-12 14:48:05 +02:00
Marco De Lucia	ddf8e97ebe	fixed initializer. Format is given by extension in the -o argument	2024-09-12 14:42:59 +02:00
Marco De Lucia	1b9906ddbf	feat: fast serialization/storage using qs package via --qs flag ... rebasing/merging	2024-09-12 14:42:24 +02:00
Marco De Lucia	9090d38f17	cosmetic fixes in DiffusionInit.cpp	2024-09-12 12:37:49 +02:00
Marco De Lucia	fc98253988	fix: removed Time-stamp lines from README and CMake/ ... Solve conflict	2024-09-12 12:37:28 +02:00
Marco De Lucia	80fc755ceb	fix: removed all Time-stamp lines from src/	2024-09-12 12:36:40 +02:00
Marco De Lucia	23d0ee51d8	fixing stuff and adding comments	2024-09-12 12:36:40 +02:00
Marco De Lucia	99f2cb5ca0	Switched default bench init storage to qs	2024-09-12 12:36:40 +02:00
Marco De Lucia	04958194c4	Fixing rebase conflicts	2024-09-12 12:36:11 +02:00