cadet/CADET-Verification: Version 0.3.0

What's Changed

• Fix chromatography system settings by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/45
• Add SMB test case by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/43
• Add EOC tests for aggregation and fragmentation in crystallization by @WFlynnZ in https://github.com/cadet/CADET-Verification/pull/44
• Modularize and expand sensitivity chromatography tests by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/50
• Add tests for multiplexing with sensitivities by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/52
• add tests for ACT isotherm by @WFlynnZ in https://github.com/cadet/CADET-Verification/pull/55
• Add and Improve Continuos Deployment for future CADET Releases by @hannahlanzrath in https://github.com/cadet/CADET-Verification/pull/58
• Add CI workflow by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/60
• Add reference solutions to crystallization tests by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/59
• Add all v504 tests to CI (as small_tests) by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/62
• Add generalized column settings by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/56
• CI: run for push on master and fix checkout of PR branch by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/69
• Add to CD: crystallization part II by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/68
• Clean up crystallization part II tests by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/72
• Add utility to compare convergence data by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/71
• Add manual dispatch to CI by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/74
• CI: Allow manual dispatch for branches by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/75
• Parameterize 2DGRM test by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/73
• Adopt code to generalized units by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/66
• Add frustum prototype test script by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/76
• Add frustum test: bwd vs. fwd flow by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/78
• Add verification debug script by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/81
• Fix radial flow EOC test: number of particle cells by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/82
• Add 1D column 4 particle types test including NONE binding with NBOUND = 0 by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/86
• Add MCT exchange sensitivity test by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/87
• Fix 1D column 4 parType test adsorption parameters by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/88
• Improve sensitivity comparison of linear MCT vs linear LRM by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/89
• Fix MCT sensitivity exchange/adsorption factor by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/90
• Fix GRM SMA LWE setting by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/91
• Fix radial LRM setting and surfDiff sensitivity by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/92
• Change LWE SMA sensitivity plots to exclude salt by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/93
• Add performance benchmark script by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/94
• Update crystallization models to new interface by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/98
• Add flexible discretization update functionality by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/100
• Add EOC tests for FV variants and non-equidistant grids by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/101
• Add tests for spline-based data driven binding models by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/97
• Update MCT reactions to new interface by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/102
• Fix spline setting: use os.path.join for filename by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/103
• Add frustum 2nd oder FV variants pure flow tests by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/106
• Add FAIRST score radar plot by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/109
• Add MCT and 2DGRM FV variant EOC tests by @Yuvraj2710 in https://github.com/cadet/CADET-Verification/pull/108
• Update interface POLYNOMIAL_INTEGRATION_TYPE by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/115
• Add ACT example with raw ion concentration by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/114
• Improve convergence comparison script by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/116
• Fix run 1D transport tests by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/117
• CI: use Docker image with 'latest' tag by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/118
• Add analytical reference (CASEMA) generation script by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/119
• Add more convergence references by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/111
• Fixes and clean up for 2D DG analysis by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/122
• Add variable porosity 2D case by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/123
• Add Gaussian Process Regression binding tests by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/105
• Add GPR binding multi-component training and simulation test case by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/131
• Add ANN binding single-component training and simulation test case by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/133
• Add ANN multi-component Langmuir training test by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/135
• Add unit tests by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/137
• CI: add codecov report by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/138
• Docs: add project badges to README by @jbreue16 in https://github.com/cadet/CADET-Verification/pull/140

New Contributors

• @WFlynnZ made their first contribution in https://github.com/cadet/CADET-Verification/pull/44
• @hannahlanzrath made their first contribution in https://github.com/cadet/CADET-Verification/pull/58

Full Changelog: https://github.com/cadet/CADET-Verification/compare/v0.2.0...v0.3.0