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Probe-Particle
/
ppafm
Classical force field model for simulating atomic force microscopy images.
MIT License
49
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18
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Remove the `tex` files from the documentation folder
#300
yakutovicha
opened
11 hours ago
0
End support for Python 3.7
#299
yakutovicha
opened
3 days ago
1
Fix some typos in examples.
#298
huangchieh
closed
1 week ago
0
Update README.md
#297
yakutovicha
closed
1 week ago
0
Update README.md
#296
ondrejkrejci
closed
2 weeks ago
1
Automatic tests failed:
#295
ondrejkrejci
closed
1 week ago
2
updating references - readme and paper_figure
#294
ondrejkrejci
closed
2 weeks ago
1
Update links to the new paper
#293
NikoOinonen
closed
2 weeks ago
7
Fix automated builds for MacOS.
#292
NikoOinonen
closed
3 weeks ago
0
Default values in the "atomtypes.ini" file
#291
prometeus3
closed
3 weeks ago
5
Fix reading atom_frac from geometry.in
#290
mondracek
closed
1 month ago
2
Reading geometry.in with fractional coordinates incorrect
#289
mondracek
closed
1 month ago
0
MacOS github runner deprecated
#288
NikoOinonen
opened
1 month ago
2
Compatibility with NumPy 2.0
#287
NikoOinonen
closed
1 month ago
1
Compatibility with Numpy 2.0
#286
NikoOinonen
closed
1 month ago
3
[pre-commit.ci] pre-commit autoupdate
#285
pre-commit-ci[bot]
closed
1 month ago
0
Mismatch between GPU and CPU simulations "pyridineDensOverlap" example
#284
prometeus3
opened
2 months ago
2
Addressing point 1 of the reviewer.
#283
ondrejkrejci
closed
3 weeks ago
5
Code benchmark
#282
NikoOinonen
closed
2 months ago
29
Make scanner work when scan_dim is passed as a non-tuple array
#281
NikoOinonen
closed
3 months ago
0
Temporarily disable one of the CI tests.
#280
NikoOinonen
closed
3 months ago
0
Continuous-integration tests keep failing, blocking any new pull request
#279
mondracek
opened
3 months ago
7
LCPD for general ranges of bias, amplitudes, tip charge and cantilever stiffness
#278
mondracek
closed
1 month ago
9
Figure out electrostatics in FDBM
#277
mondracek
opened
3 months ago
0
Fixing FHI-aims electron densities for FDBM
#276
NikoOinonen
opened
4 months ago
4
Implement `PpafmParameters` class based on `pydantic.BaseModel`
#275
yakutovicha
closed
11 hours ago
7
[pre-commit.ci] pre-commit autoupdate
#274
pre-commit-ci[bot]
closed
5 months ago
1
Generator update
#273
NikoOinonen
closed
5 months ago
2
Make KPFM work for a range of amplitudes, probe-particle stiffness parameters etc.
#272
mondracek
closed
1 month ago
0
updated naming in README and addding the arxiv manuscript
#271
ondrejkrejci
closed
4 months ago
4
KPFM examples
#270
mondracek
closed
5 months ago
8
Python API GPU tutorial
#269
NikoOinonen
closed
5 months ago
5
Add tutorial for the AFMulator
#268
NikoOinonen
closed
5 months ago
0
Tutorials for using the GPU-accelerated Python API
#267
NikoOinonen
opened
6 months ago
0
Too many names
#266
yakutovicha
closed
4 months ago
4
API docs update
#265
NikoOinonen
closed
6 months ago
3
Clean-up the API doc pages
#264
NikoOinonen
closed
6 months ago
0
Windows wheel build failing
#263
NikoOinonen
closed
6 months ago
2
Adding the FePc_Au-IETS example
#262
ondrejkrejci
closed
6 months ago
5
new version, of PPAFM released and added to Zenodo description
#261
ondrejkrejci
closed
6 months ago
4
Adding a beter description for the Zenodo database of images
#260
ondrejkrejci
closed
6 months ago
17
Adding the FePc example to the examples
#259
ondrejkrejci
closed
6 months ago
0
Proper documentation for the FDBM (full denity based method) is missing
#258
mondracek
closed
4 months ago
12
DFT-D3 van der Waals does not work correctly with hydroxyl (-OH) groups
#257
mondracek
closed
3 weeks ago
22
The "tip" option in params.ini does not work
#256
mondracek
opened
7 months ago
0
Add the FFPB_KPFM example
#255
mondracek
closed
7 months ago
2
Add labels to color bars
#254
mondracek
closed
7 months ago
1
Labels need to be added to the color bar in PNG images
#253
mondracek
opened
7 months ago
3
Too large color bar makes png figures ugly
#252
mondracek
closed
7 months ago
3
Correct sign of densities and potentials in KPFM
#251
mondracek
closed
7 months ago
2
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