Na 11
GGA-PBE loggrid 2001
3 2 0 0 0 0 
3 0 1   
0 0 0 
c 
v 
v 
v 
1
1.8
n 
y
2
n 
VANDERBILT   
2 0
1.8
1.8
1.8
1.8
0