Use pyscf's hcore function rather than handrolled #177
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Codecov Report
@@ Coverage Diff @@
## develop #177 +/- ##
===========================================
- Coverage 55.23% 55.23% -0.01%
===========================================
Files 165 165
Lines 23674 23670 -4
===========================================
- Hits 13077 13074 -3
+ Misses 10597 10596 -1
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Should be less error prone. Addresses #176 .