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As the conversion happens in `WeightedNNBasedLinesetMatching()`, this means that the objects are converted for every comparison, not just once at the start, making everything much slower than it needs…
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Thanks for the new version of eDMFT. The program was installed perfectly and it works perfectly. Is it possible to add a little more information in docs about the calculations of DOS, bands..., in the…
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Hello,
I've noticed that using MAGMA's `torch.eig` on a CUDA device leads to different results thatn using the torch.eig on CPU. I've implemented an algorithm using eigen decomposition, and while the …
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With some forms of simulation stochasticity, the numbers of individuals in each state needs to be rounded
- [ ] What is the specific use case?
- [ ] Priority is to figure out the priority of these…
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This was queried by a user, my answer was:
> I think the vector is in the coordinate system you are after and you don't need to transform it. The
> reference frame for the unit vectors describing th…
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I am trying to run with a large data set, ~200,000 eBOSS spectra, and stumbled upon an issue with memory.
What would be the best strategy to deal with that?
Is there an option `float32`, or should I…
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#### Describe the bug
There is vast literature in numerical linear algebra that advise against inverting the matrix directly unless you have a very good reason. Specifically in vecm.py, the _sij fu…
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Because it seems that the function which calculates the eigenvalues only returns one eigenvalue for the whole model.
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Hi could you provide installation instructions and some examples please?
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It would be nice if multiple modes could be animated simultaneously, like [this example](https://www.youtube.com/watch?v=dGVaU3o3Ve4). There is a primitive implementation (which reads from the phonopy…