pyiron / pyiron/lammpsparser

[Bug] Reference to pyiron units in warnings

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bug
Dominant language
Python
Stars
6
Forks
5
Avg merge
1h 37m
Merged PRs (30d)
6

Description

We often get warnings of the form

lammpsparser/units.py:242: UserWarning: Warning: Couldn't determine the LAMMPS to pyiron unit conversion type of quantity Density. Returning un-normalized quantity
  warnings.warn(

Since lammpsparser is no longer dependent on pyiron, perhaps the documentation of the lammpsparser could mention what this unit conversion does and include a reference to pyiron units.

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First steps

  1. Read the whole issue, then the project's contributing guide.
  2. Comment on the issue to say you are picking it up — it saves two people doing the same work.
  3. Fork the repository and make your change on a branch.
  4. Open a pull request that references the issue number.

Research direction

Start with lammpsparser/units.py:242 and trace the unit-conversion behavior behind the warning. Find the project documentation location, explain what the LAMMPS-to-pyiron unit conversion does, and add a reference to pyiron units. Done means the documentation covers this warning and its conversion context.

Written by the indexing model from the issue text.

Assessment

Tech stack
python
Domain
documentation
Issue type
Documentation
Difficulty
2/5
Estimated time
1-3 hours
Activity status
Quiet
Clarity
Mostly clear
Newbie friendliness
55/100

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