v0.2.0

What's Changed

• simplifying makefile & making it work on my macos by @ltalirz in #3
• fixed cppflags by @ltalirz in #4
• Mention license in the README. by @yakutovicha in #17
• Delete old_gui. Fixes #18 by @NikoOinonen in #28
• Deleted commented-out lines of code. Fixes #20. by @NikoOinonen in #29
• Code reorganization. Fixes #19, fixes #21, fixes #23. by @NikoOinonen in #30
• Deleted old OCL related functions no longer in use. by @NikoOinonen in #37
• Initial version of sphinx docs by @NikoOinonen in #36
• Fix for grid step size. by @NikoOinonen in #41
• Readthedocs by @NikoOinonen in #44
• Master kpfm by @aureliojgc in #45
• Simplified xyz IO functions by @NikoOinonen in #49
• apos -> poss by @alexriss in #54
• Provide pypackage.toml, rename root module to ppafm by @yakutovicha in #57
• Fix for missing submodules in package build. by @NikoOinonen in #59
• Updated doc page URL in README. by @NikoOinonen in #66
• Enable pre-commit checks by @yakutovicha in #62
• GUI fixes by @NikoOinonen in #67
• After62 by @ondrejkrejci in #73
• Add initial Docker setup. by @yakutovicha in #56
• Prokop damp func by @ProkopHapala in #87
• Update .gitignore. by @yakutovicha in #98
• C++ code compilation for pip wheel by @NikoOinonen in #92
• Fixed deprecated use of .clear() on Axes.ArtistList in GUIWidgets.py by @NikoOinonen in #100
• Fix for deprecated use of numpy data types. by @NikoOinonen in #101
• Install top-level scripts with pip. by @yakutovicha in #102
• Prepare release 0.2.0a1 by @yakutovicha in #104
• Fixed run.bat for the graphene example. by @NikoOinonen in #111
• Add pytest and github action to execute it by @yakutovicha in #117
• Removed "For developers" sections from README by @NikoOinonen in #122
• Clean dev by @ProkopHapala in #121
• Fix CI tests by @NikoOinonen in #125
• IO related code reorganization by @NikoOinonen in #103
• Fix for sign issues in electrostatics and Pauli calculations. by @NikoOinonen in #124
• Completes renaming "basUtils" to "io" by @mondracek in #127
• Rename basUtils to io also in sphinx docs. by @NikoOinonen in #132
• Remove remaining sys.path manipulation. by @NikoOinonen in #131
• Full-density based model in OpenCL by @NikoOinonen in #130
• Parameter saving/loading from params.ini for AFMulator and the GUI by @NikoOinonen in #139
• Removed locale change in ReadNumsUpTo that was causing trouble. by @NikoOinonen in #141
• Added clarity for changing values of GUI widgets. by @NikoOinonen in #140
• Implemented normalization to power raising method for DataGrid. by @NikoOinonen in #143
• Fix coordinate offset in OpenCL force field interpolation. by @NikoOinonen in #145
• Implement tip density resampling. by @NikoOinonen in #147
• Fix to OpenCL compilation paths. by @NikoOinonen in #151
• Chore: move dev/fitPPM to ppafm/cli/fitting by @yakutovicha in #152
• Fix sign of electrostatic force in density overlap. by @NikoOinonen in #159
• set atomic number of Cl to 17 by @alexriss in #160
• Fixing issue with saving numpy format by @ondrejkrejci in #154
• Added g++ and make to readthedocs build requirements. by @NikoOinonen in #162
• Add Grimme-D3 calculation by @NikoOinonen in #163
• Set maximum for initial scan size in GUI. by @NikoOinonen in #164
• Implemented DFT-D3 in the CPU code. by @NikoOinonen in #166
• Set fixed locale during array read. by @NikoOinonen in #168
• Automate release with bumpver by @yakutovicha in #171
• Release automatically on PyPi by @yakutovicha in #170
• Temporary disable wheel build. by @yakutovicha in #173
• Improve the README.md file by @yakutovicha in #172
• Replaced origin='image' with origin='lower' in PPPlot.py by @LauriKurki in #174

New Contributors

• @ltalirz made their first contribution in #3
• @yakutovicha made their first contribution in #17
• @NikoOinonen made their first contribution in #28
• @aureliojgc made their first contribution in #45
• @alexriss made their first contribution in #54
• @ondrejkrejci made their first contribution in #73
• @ProkopHapala made their first contribution in #87
• @mondracek made their first contribution in #127
• @LauriKurki made their first contribution in #174

Full Changelog: v0.1...v0.2.0