error in Berry phase calculation

[zhongshanluo]

Dear admin:
I encountered this error when running the vasp 4.6, I am doing the polarization calculation of the example provided by
http://cms.mpi.univie.ac.at/vasp/vasp/node157.html
Calculation 1
KPOINTS file:
4x4x4
0
Monkhorst
4 4 4
0 0 0

POSCAR file:
NaF
4.5102
0.0 0.5 0.5
0.5 0.0 0.5
0.5 0.5 0.0
1 1
Direct
0.0000000000000000 0.0000000000000000 0.0000000000000000
0.5000000000000000 0.5000000000000000 0.5000000000000000

INCAR files:
general:
system = cubic NaF
ISTART = 0
ICHARG = 2

The POTCAR is cat from PAW_GGA

Calculation 2
KPOINTS file:
4x4x4
0
Monkhorst
4 4 4
0 0 0

POSCAR file:
NaF
4.5102
0.0 0.5 0.5
0.5 0.0 0.5
0.5 0.5 0.0
1 1
Direct
0.0000000000000000 0.0000000000000000 0.0000000000000000
0.5000000000000000 0.5000000000000000 0.5000000000000000

INCAR files:
general:
system = cubic NaF
ISTART = 0
ICHARG = 11
LBERRY = .TRUE.
IGPAR = 1
NPPSTR = 6
DIPOL = 0.25 0.25 0.25

The POSCAR as before.
but after the calculation, an error always occurs in the OUTCAR:
an error always occurs in the OUTCAR:

k-mesh defined as follows:
IGPAR = 1
NKPTS = 216 NSTR = 36 NPPSTR= 6
Expectation value term: <R>ev
<R> = ( 0.00000, 0.00000, 0.00000 ) electrons Angst

Error in subroutine BERRY: did not find all determinants

Matrix CMK is not an nxn matrix for
ISTR = 1 j = 0

I have try to set the k-points as
k-points
0
Monkhorst Pack
21 21 21
0 0 0

But the problem still exist, would you give me some advise?

Best wishes.

[chlee]

I had same problem but i solve the problem by increasing NPPSTR-tag.

[lieshan]

Perhaps the question is your VASP's version.