The atomic LDA calculation of Eu
***************************************************
Input file
***************************************************
System.CurrentDirectory ./
System.Name Eu0
<<< Calculation type >>>
eq.type sch
calc.type ALLFEM
xc.type LDA
<<< Atom >>>
AtomSpecies 63
max.ocupied.N 6
total.electron 63.0000
valence.electron 17.0000
grid.xmax 10.000 # rmax=xmax^2
grid.num 7937
<<< SCF >>>
scf.maxIter 200
scf.Mixing.Type Simple
scf.Init.Mixing.Weight 0.10000
scf.Min.Mixing.Weight 0.00100
scf.Max.Mixing.Weight 0.40000
scf.criterion 1.000e-100
*****************************************************
Eigenvalues (Hartree) in all electron calculation
*****************************************************
n= 1 l= 0 -1672.309322160887555
n= 2 l= 0 -265.199534558418947
n= 2 l= 1 -252.176697463339061
n= 3 l= 0 -58.068128116463385
n= 3 l= 1 -52.281987405573624
n= 3 l= 2 -41.465517658951720
n= 4 l= 0 -11.267747545079960
n= 4 l= 1 -9.025455346060519
n= 4 l= 2 -5.032419888441974
n= 4 l= 3 -0.232773257802933
n= 5 l= 0 -1.444087316720661
n= 5 l= 1 -0.853575385092863
n= 6 l= 0 -0.129426514830199
*****************************************************
Energies (Hartree) in all electron calculation
*****************************************************
Etot = -10419.710774638047845
Etot = Ekin + EHart + Exc + Eec
Ekin = 10415.168161486880849
EHart = 4124.189853816710749
Eec = -24732.674216343264490
Exc = -226.394573598374949
Exc = Ex + Ecorr = (Ex-Ekin_x) + (Ecorr-Ekin_c) + Ekin_x + Ekin_c
Ex = -220.158924121081245
Ecorr = -6.235649477293704
Ekin_x = -0.000000000000000
Ekin_c = 4.542613151120905
Eeigen = -6369.471574303755293
Virial theorem 2*(Ekin+Ekin_x+Ekin_c)+(EHart+Eec+Exc-Ekin_x-Ekin_c) = -0.000000000046091
Virial theorem (EHart+Eec+Exc-Ekin_x-Ekin_c)/(Ekin+Ekin_x+Ekin_c) = -2.000000000000004