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Re: [abinit-forum] Re: difference density


Chronological Thread 
  • From: Steven Homolya <steven.homolya@spme.monash.edu.au>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] Re: difference density
  • Date: Wed, 25 May 2005 00:16:30 +1000

myid520@163.com wrote:
Dear Homolya: I don't know what's the quickest way to get the difference
electron density. But I can tell you how I get the the difference electron
density of a adsorbate-substrate system. The method I get it is through
subtracting the total electron density of adsorbate and substrate by the
total electron density of adsorbate-substrate system.


Thanks, but that's quite different from what I was after.

BTW. I didn't really mean the "quickest" way, just one that is not too
tedious.

Cheers,

Steve



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