diffsims
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pyxem
An open-source Python library providing utilities for simulating diffraction
**Is your feature request related to a problem? Please describe.** I've been looking into doing some more 4-D STEM type simulations (kinematic, prism, multislice) and wanted to add this functionality...
A couple of things jump out 1) How we handle the direct beam - One option would be to assign a fixed proportion of the total intensity (say 50%) into...
It would be nice to add Kikuchi lines to basic simulations using a simple geometric model. Perhaps starting with zone axis geometries only. @hakonanes - don't know if you know...
There are some probe function things here, that we should think about supporting: https://github.com/ePSIC-DLS/epsic_tools/pull/15/files E.g. aberration function: def FuncAberrUV(u,v,aberrcoeff): # this function needs comments # input: # u: Kx #...
We depend on diffpy.structure for atomic structure manipulations but perhaps currently under-utilise some of the functionality of that package. One example is that the is_lattice_hexagonal() function in sim_utils is probably...
I just saw that in Pyxem it's called rocking angle. Maybe we can change precession angle in here for consistency and check whether there are other inconsistencies in nomenclature.
Hi, I am currently trying to learn how to do spot pattern indexing using the kinematic diffraction from `diffsims`. However, depending how finely I want to discretize the reduced fundamental...
**Is your feature request related to a problem? Please describe.** In some CIF files, atoms are given by their ionic names (e.g. Fe2+ instead of Fe). This is (sometimes) the...
The conda-forge feedstock build failed due to the test using the `diffsims/tests/generators/old_simulation.npy` file: * PR: https://github.com/conda-forge/diffsims-feedstock/pull/13 * Failing build step: https://dev.azure.com/conda-forge/feedstock-builds/_build/results?buildId=949361&view=logs&j=656edd35-690f-5c53-9ba3-09c10d0bea97&t=986b1512-c876-5f92-0d81-ba851554a0a3 As a temporary solution to release 0.6.0 on conda-forge,...
**Describe the bug** Hello everyone, I am currently following the Fast Template Matching scripts (https://pyxem.readthedocs.io/en/v0.19.1/tutorials/pyxem-demos/11%20Accelerated%20orientation%20mapping%20with%20template%20matching.html) to map the crystal orientation in my samples. I followed the instruction in the tutorial...
