Closed jcwang587 closed 3 months ago
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The recent modifications streamline the xdatbus
Python package by updating its version and refactoring the fmtd07_neb.py
script. The version bump advances xdatbus
from 0.2.11
to 0.2.12
. In fmtd07_neb.py
, unnecessary code was removed to concentrate solely on the NEB calculation function, optimizing the script for performance and readability.
File | Change Summary |
---|---|
pyproject.toml |
Updated xdatbus package version from 0.2.11 to 0.2.12 . No other metadata changes. |
xdatbus/fmtd07_neb.py |
Refined to focus on the NEB calculation function. Removed redundant code related to loading data, finding minima, constants, and plotting. |
In the realm of code where data flows, A version bumped, the package grows. 📈 With clutter gone, the NEB shines bright, Simpler paths, smoother flight. ✨ Rabbits cheer in lines of lore, For code refined, they all adore! 🐇💻
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Summary by CodeRabbit
Chores
xdatbus
package to version0.2.12
.Refactor