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I wish to ask for clarification surrounding the definition of the symmetry axis for an abel transform.
For my application, I wish to define a symmetry axis that is centred on the image, and vertica…
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```swift
extension String {
subscript(idx: Int) -> String? {
guard (0.. String {
let start = index(startIndex, offsetBy: max(0, range.lowerBound))
let end = index(star…
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How hard would it be to make a function that maps a point in the first BZ to its symmetrically identical point in the irreducible BZ? I am trying to integrate/sum over the first BZ and it would be nic…
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I get an error pyscf.lib.exceptions.PointGroupSymmetryError: Unable to identify input symmetry C3v. Try symmetry="C3v"
Here is my input:
```
from pyscf import scf, M
from pyscf import symm
# …
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I have been playing around with the `symmetry=True` argument for the `Cell` object, in the `kpoints_symm` branch, for the NV- center in diamond (with PBCs). I'd like to enforce its C3v point group sym…
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Trying to put a point in the middle of an edge but the program wouldn't let me. I have tried selecting all the vertices under the spline on a different rectangle which had only the upper spline (so th…
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We get the Cartesian coordinates of a direct [uvw] or reciprocal lattice vector (hkl) in any of the seven crystal systems (triclinic, monoclinic, orthorhombic, trigonal, tetragonal, hexagonal, and cub…
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I want to create a plot of the temporal sequence of my intersection of my index and markers.
I can create the correct plot using the following code:
```
temporal_symmetry
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Currently, if we want to compute the `PlasmaVesselDistance` objective for two surfaces with `NFP>1`, and let's say the surface is such that for the point on the plasma surface at $(\theta=0, \zeta=0)$…
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I am wondering if it would be sensible to add the functionality to convert orix quaternion to scipy rotation (the reverse is already possible with `Rotation.from_scipy_rotation`). I would find it usef…