[Wien] the total energy of N2

[xn22 at drexel.edu]

I think this depends on which ex, bond length, RKmax.
My resutl is -218.610751 with GGA(pw91), bond length of 1.2 A and 3.66 as RKM.

How about your paramters?

Xiliang
----- Original Message -----
From: george bush <originw2000 at yahoo.com>
Date: Monday, November 24, 2003 1:30 pm
Subject: [Wien] the total energy of N2

> Hi, my dear buddies,
> this email is just to find  another guy who have
> calculated the total energy of N2. my result is
> -219.048035 Ry, how about yours? please let me know.
> 
> in addition, THANKSGIVING is coming, happy holiday!
> 
> Rubbi
> 
> 
> 
> 
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