How to print spin density values (open shell system )

arobendo mondal aroben... at gmail.com
Wed Jun 17 19:53:29 UTC 2015


Dear all,

How to print the SPIN DENSITY AT THE NUCLEAR POSITIONS ? 

I am able to generate the   " *SPIN_DENSITY-1.cube " file. but I don't have 
any idea how to extract the spin density values from here.

I am using 

     &E_DENSITY_CUBE

        TOTAL_DENSITY

     &END E_DENSITY_CUBE


Any suggestion what can be done.


Best wishes

Arobendo 
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