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Hi @mkhorton @davidwaroquiers @mjwen. Agreed that we need a proper discussion about restarting. This is something @jmmshn has opinions about too.
I have some ideas for how we could do it but each w…
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Two sets of two elements share duplicate RGB values in the VESTA color scheme in `ElementColorSchemes.yaml`. This leads to visual ambiguity in the rendered structures for materials with these elements…
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https://github.com/materialsproject/pymatgen/blob/fcb84a1e129da3a3010b9f6b9cf18beddf39f245/pymatgen/core/lattice.py#L310-L363
It would be great if pymatgen also supported FPLO conventions on lattic…
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We depend on diffpy.structure for atomic structure manipulations but perhaps currently under-utilise some of the functionality of that package.
One example is that the is_lattice_hexagonal() functi…
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```python
with MPRester(api_key) as mpr:
mpr.provenance.search(nsites=(1, 52), elements=["V"])
```
> ```bash
> Traceback (most recent call last):
> File "", line 1, in
> File "C:\Users…
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### Problem
I would like to cache the results of API calls, as documented as point 4 in https://docs.materialsproject.org/downloading-data/using-the-api/tips-for-large-downloads
When I try the cal…
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https://github.com/materialsproject/emmet/blob/31a226297f3677098e61da13b8e7fe4ea6177fdd/emmet-core/emmet/core/thermo.py#L251-L253
When these `PhaseDiagramDocument`s are pulled from the DB and deser…
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We sometimes observed https://api.materialsproject.org/heartbeat responds a 403 error, then mp-api just raises JSONDecodeError.
It would be nice to show users a 403 error, and what could happen such …
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We should consider supporting the NOMAD databases JSON format. There are several advantages to this format, mostly its native interoperability with the NOMAD database and the large number of parsers a…