Chi Cheng

We will need to update the atom database editor as you can now enter any string for their scattering lengths. 

> The output data are `np.float64` again. Also, `assign_weights` now takes a complex conjugate of every other pair of atom types, which I thought would be an implementation of the...

> The output data are `np.float64` again. Also, `assign_weights` now takes a complex conjugate of every other pair of atom types, which I thought would be an implementation of the...

I did some more thinking. This is related to the above comment. Since, ```math 2 \mathrm{Re} [C_{AB}(q, t)] = C_{AB}(q, t) + C_{AB}(-q, t) ``` so in this branch, we...

Looks, good so far. I've found one issue with the project coordinates configurator. For the axial and planar projection, you can input the vector of zeros, this causes the jobs...

So far I have found some minor issues (#577, #576, #575 and #574) which I think we need not fix for this release. There is a lammps trajectory conversion failure...

It looks good all my lammps test trajectories work fine now. Can we update the self-part of the van Hove function so that it gives the same error as the...

I have identified two new issues we may want to try to fix #579 and maybe #581. For #581 It might be better to deactivate the unfolded trajectory job for...

Looks like #580, #576 and #577 are fixed now. Still one minor visual issue with the q_vector generator is that when you use a vector or range of 4 or...

This paper looks useful. https://pubs.aip.org/aip/apl/article-abstract/71/18/2692/518167/Infrared-absorption-in-amorphous-silicon-from-ab?redirectedFrom=PDF