# Generalities
Title = "Silicum"
CalculationMode = ae + pp
Verbose = 40

# Hamiltonian
WaveEquation = schrodinger
SpinMode = unpolarized

XCFunctional = lda_x + lda_c_pw 

# Specie
NuclearCharge = 14

%Orbitals
"Ne"
  3  |  0  |  2
  3  |  1  |  2
  3  |  2  |  0
  4  |  3  |  0
%

# PseudoPotentials
PPScheme = ham

%PPComponents
  3  |  0  |  1.2
  3  |  1  |  1.27
  3  |  2  |  1.5
  4  |  3  |  1.9
%

PPCalculationTolerance = 1e-6

# Wave-equations solver
EigenSolverTolerance = 1e-6
ODEIntTolerance = 1e-6
