[Pw_forum] crash in pslibrary.0.2.2

[Nicola Marzari]

Hi David,


it worked for me a couple of days ago, with gfortran/gcc on a Macbook
Air. Can you try a couple of different compilers, or platforms, to see 
if that solves it?

			nicola



On 11/19/11 12:25 AM, David Strubbe wrote:
> Dear QE developers,
>
> I would like to report some problems with pslibrary.0.2.2. Everything
> works fine for me when I do make_all_ps, except the input files below
> which cause ld1 to crash with the respective error messages, which occur
> consistently.
>
> David Strubbe
> UC Berkeley
>
>
> Bi.pbe-rrkjus.in <http://Bi.pbe-rrkjus.in>, Bi.pz-rrkjus.in
> <http://Bi.pz-rrkjus.in>, Bi.rel-pz-rrkjus.in
> <http://Bi.rel-pz-rrkjus.in>, Bi.rel-pbe-rrkjus.in
> <http://Bi.rel-pbe-rrkjus.in>
>
> from compute_q_3bess : error # 1
> problem with the q_i coefficients
>
> Ti.pbe-nc.in <http://Ti.pbe-nc.in>
>
> from run_pseudo : error # 1
> Errors in PS-KS equation
>
>
>
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-- 

----------------------------------------------------------------------
Prof Nicola Marzari, Chair of Theory and Simulation of Materials, EPFL