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jarvist committed Jan 27, 2016
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Expand Up @@ -43,4 +43,4 @@ have to comment out some calculations attempted (on non-existant orbitals) in
get_J.m


Compare examples/ethylene_b3lyp with Figure 1 in JACS 2006 128 9882-9886
Compare examples/ethylene_b3lyp with Figure 1 in JACS 2006 128 9882-9886 http://dx.doi.org/10.1021/ja061827h

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