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BoothGroup / ebcc

Coupled cluster models for both purely electron and coupled electron-boson models, with a focus on generality and model extensibility.
https://boothgroup.github.io/ebcc/
MIT License
11 stars 2 forks source link

Remove moments #71

Closed obackhouse closed 1 month ago

obackhouse commented 1 month ago

The moments functionality only offers CCSD moments which are already available in PySCF despite taking up a significant amount of code. I will reimplement this once (if) I have a consistent way to generate the expressions for general ansatzes.

codecov[bot] commented 1 month ago

Codecov Report

Attention: Patch coverage is 75.00000% with 1 line in your changes missing coverage. Please review.

Project coverage is 98.14%. Comparing base (c4c4133) to head (f25d921).

Files Patch % Lines
ebcc/eom/base.py 0.00% 1 Missing :warning:
Additional details and impacted files ```diff @@ Coverage Diff @@ ## master #71 +/- ## ========================================== - Coverage 98.45% 98.14% -0.31% ========================================== Files 88 88 Lines 98600 98264 -336 Branches 923 814 -109 ========================================== - Hits 97077 96445 -632 - Misses 1340 1649 +309 + Partials 183 170 -13 ```

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