globus-labs / faster-molecular-hessians / 6027521180
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coverage: 96.721% (+0.4%) from 96.296%
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Add linear terms to harmonic model (#6)

* Refactor and add linear terms

Fixes #2
Fixes #4

* Make the second-order terms 1/2 the first order

* Update with the newer model

* Update the proof of concept notebooks

24 of 24 new or added lines in 1 file covered. (100.0%)

59 of 61 relevant lines covered (96.72%)

0.97 hits per line

Jobs
ID Job ID Ran Files Coverage
1 6027521180.1 0
96.72
Source Files on build 6027521180
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