Evgeny Blokhin
Evgeny Blokhin
Well, it's not the Einstein's riddle is difficult, it's that the `OWL2 QL/RL` is difficult :) And as far as I understand, the only way to tackle this difficulty is...
Also https://github.com/RDFLib/OWL-RL/issues/14#issuecomment-462142764
@bijancn unfortunately, your solution does not work for me. I had to split my `defintions` in JavaScript into several separate schemata and render them individually. Gosh.
Are you really sure the POST is needed? Two observations on that: - according to the HTTP semantics, POST modifies the content, and apparently OPTiMaDe is far from that at...
Following the discussion with @sauliusg I can also point out many edge cases where the `experimental` or `theoretical` nature is not immediately clear. An example is de-novo crystal structure refinement,...
cf. _computational experiments_ vs. _experimental modeling_
Unfortunately it starts to be complicated here. Imagine we took an experimental structure and relax it fully with the DFT, ending up with the different cell, symmetry, atomic positions, etc....
cf. https://github.com/Materials-Consortia/OPTIMADE/issues/406
@rartino should this be closed by https://github.com/Materials-Consortia/OPTIMADE/pull/405?
I'd stick to the [IUCr definition](https://www.iucr.org/__data/iucr/cifdic_html/1/cif_core.dic/Ispace_group_symop_operation_xyz.html), however probably there is no need to require symops for the standard settings / origins. So if they are omitted, one should assume [ITC](https://it.iucr.org).