-
Carsten could provide datasets which have DOIs in it and these should be available also in the LDM instance.
-
In molecular dynamics simulations at constant temperature and pressure of certain porous crystals such as metal/covalent organic frameworks -- and probably also other solids -- it is necessary to use …
-
I'd like to ask why do we still need metal atoms to build cifs after X atoms added.
-
## Bug description
RunTimeError when choosing CIF format via ASE.
### Expected behaviour
CIF format via ASE should be a valid option.
## Reproducibility
Choose any structure and try to …
-
## Bug description
The `IntRangeSlider`s cannot update their min/max-values, if out of range of the current values.
Furthermore, the Search button should return to "normal" even upon error.
#…
-
## Bug description
Upon choosing the first provider/database nothing happens.
### Expected behaviour (optional)
For a provider with only a single database, it should be chosen and the databas…