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Or, more precisely, group paths using the recent `GroupPath` features introduced in AiiDA
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In a not-so-recent commit, the error message related to a double reset of the history of the BFGS algorithm was changed _in some cases_ in the output of Quantum ESPRESSO to print `exiting` instead of …
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In https://github.com/aiidateam/aiida-core/pull/5073, the entry points of plugins that ship with `aiida-core` are prefixed with `core.`. Once this change has been released, the tutorial material must …
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See e.g. here: https://www.materialscloud.org/explore/curated-cofs/grid/calculations
![Screenshot 2020-04-26 at 13 28 36](https://user-images.githubusercontent.com/1053245/80306160-d928f780-87c1-11…
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I open this issue to brainstorm on the features that might be needed for having a push-pull mechanism (similar to git) to mirror two AiiDA DBs. Once implemented, using a third central place (similar t…
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I setup the AiiDA explorer (cool!) and got this error when trying to see the codes, after setting up both `aiida.database` and `aiida.database` (I think correctly - I see groups and processes). I get …
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https://github.com/marvel-nccr/ansible-role-aiida/commit/e37869de1ff71e97870c9692ca3ccf4850f2935b completely dropped any testing on the RedHat line (CentOS/Rocky/Alma), which is still a popular Linux …
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When we are dealing with frequency, uv-vis, and emission spectra calculations, we generate files with arrays of numeric data which can later be used for visualization.
I need to check `ArrayData`, `…
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## Environment
* Operating system: macos
* aiida-core version/branch+commit: 1.6.8
* aiida-vasp version/branch+commit: latest develop 7c0bee1897099f95781f1a79b268bba43dc5d2c1
## Steps that le…
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## Motivation
When computers and codes were originally designed, a certain level of rigidity on their properties was established in order to try to impose a stricter level of control over the prese…