[CPMD-list] RECPNEW| &ATOM SECTION NOT FOUND

[Juerg Hutter]

Hi Keta

your problem is that in the PP specification you need the
additional keywords "NEWF BINARY"
>
> &ATOMS
> *O-ca--bm
>    LMAX=P
>    1
>    11.811 10.000 10.000   O

Correct is

*O-ca--bm NEWF BINARY
  LMAX=P
  1
....

Juerg