[Wien] Re; EV-GGA

Rashid Ahmed rasofi at hotmail.com
Thu Nov 15 12:34:31 CET 2012


Yes replace 13 with 25 in ino file and save. Then run scf. cheers
 
Date: Thu, 15 Nov 2012 11:08:45 +0000
From: karimaphy at yahoo.fr
To: wien at zeus.theochem.tuwien.ac.at
Subject: [Wien] Fw :EV-GGA







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Dear Wien2k users, 

 
I want to calculate the EV-GGA in case .in0 
 case.in0 : ToT 13 ( 5...CA-LDA, .....13....PBE-GGA, 11....WC-GGA )
so, I changed in this case in red by 25...PBE-GGA
it's correct or no

thanks 

 		 	   		  
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