SYSTEM = BiVO4

LSOL   =   T     #  
EB_K   =  78.5   #      
SIGMA_K=   0.6   # 0.600000  width of the dielectric cavity
NC_K   =  37E-4  # 0.002500  cutoff charge density (25E-4)
TAU    = 525E-6  # 0.000525  cavity surface tension

NELM=200 #max number of electronic steps
EDIFF=1E-5 #energy convergence criterion
ISMEAR = 0 #gaussian 
SIGMA=0.03 #smearing width in eV
ISPIN=1 # 1 for non-spin polarized, 2 for spin-polarized calc.

NWRITE = 2
LAECHG = T
van der Waals:                                          
  LVDW   =   T                                          
  VDW_VERSION= 2 ; VDW_RADIUS = 40 ; VDW_SCALING = 0.75 
# Parameters:  Ag  
  VDW_C6 =    5.481
  VDW_R0 =    1.819