[Pw_forum] cp.x output: .pos
Paolo Giannozzi
giannozz at democritos.it
Sat Aug 18 21:00:58 CEST 2012
On Aug 6, 2012, at 18:11 , xiaochuan Ge wrote:
> That is, different snapshots are separated by an extra line which
> indicates the step number and the time of this snapshot. But with
> the newest version that I compiled on cineca-plx, this extra line
> disappears.
In CPV/src/printout_base.f90, locate lines 220 and 221:
IF( PRESENT( nfi ) .AND. PRESENT( tps ) ) THEN
ELSE IF( PRESENT( what ) ) THEN
insert the following line:
WRITE( iunit, 30 ) nfi, tps
between the two lines above. It has been removed by mistake,
as it is evident from the absence of any instruction between
IF and ELSE
P.
---
Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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