@Aravindh-Nivas-M

Aravindh Nivas M

1 Questions 1 Answers 0 Followers

Questions related from Aravindh Nivas M

How do we calculate atomic spin density using Molpro?

I want to calculate CASSCF/CC-PVDZ for C4 molecule in triplet state. Thus I want to know the spin density of each atom.

21 May 2017 1,720 3 View

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