ZORA in nwchem

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2:55:06 AM PST - Tue, Jan 17th 2017
Quote:Niri Oct 16th 7:27 pm
Hi Juha,

The SO properties are still in development.

Best,
-Niri


Apparently, this is still the case in 6.6? Just tried spin-orbit ZORA NMR shielding calculation without success...

Best, Juuso


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