Error: ksecul/zpotrf failed: 52 60 at K 14 0.083333
Error: ksecul/zpotrf failed: 60 60 at K 3 0.416667
Error: ksecul/zpotrf failed: 53 60 at K 4 0.416667
Error: ksecul/zpotrf failed: 52 60 at K 5 0.416667
Error: ksecul/zpotrf failed: 55 60 at K 18 0.083333
Signal Caught: 15
Error: ksecul/zpotrf failed: 60 60 at K 8 0.250000
Error: ksecul/zpotrf failed: 52 60 at K 9 0.250000
Error: ksecul/zpotrf failed: 52 60 at K 10 0.250000
Error: ksecul/zpotrf failed: 52 60 at K 11 0.250000
Error: ksecul/zpotrf failed: 52 60 at K 12 0.250000
When I try to add electrical field to the system ,there is alaws the above err.What's the matter ? ,and my input is as follows :
# Task parameters
Calculate optimize
Opt_energy_convergence 2.0000e-005
Opt_gradient_convergence 4.0000e-003 A
Opt_displacement_convergence 5.0000e-003 A
Opt_iterations 1000
Opt_max_displacement 0.3000 A
Lattice_optimization on
Simple_geometry_opt
Symmetry off
Max_memory 16000
# Electronic parameters
Spin_polarization unrestricted
Charge 0
Basis dnd
Pseudopotential dspp
Functional pbe
Aux_density octupole
Integration_grid medium
Occupation thermal 0.008
Cutoff_Global 3.4000 angstrom
Scf_density_convergence 1.0000e-005
Scf_charge_mixing 0.2000
Scf_spin_mixing 0.5000
Scf_iterations 999
Scf_diis 6 pulay
Electric_Field 0 0 -0.08
# Kpoint definition file (intervals/offset):
Kpoints file 6 6 1 0.0000 0.0000 0.0000
1.kpoints
# Calculated properties
