something wrong in running yambo

Deals with issues related to computation of optical spectra in reciprocal space: RPA, TDDFT, local field effects.

Moderators: Davide Sangalli, andrea.ferretti, myrta gruning, andrea marini, Daniele Varsano, Conor Hogan

Post Reply
flybird0303
Posts: 2
Joined: Thu Dec 05, 2013 3:37 pm

something wrong in running yambo

Post by flybird0303 » Wed Dec 11, 2013 2:29 am

No matter what I try to calculate, the yambo is killed with a signal below
<---> [01] Files & I/O Directories
<---> [02] CORE Variables Setup
<---> [02.01] Unit cells
<---> [02.02] Symmetries
<---> [02.03] RL shells
<---> [02.04] K-grid lattice
<---> [02.05] Energies [ev] & Occupations
<---> [03] Transferred momenta grid
<---> X indexes |####################| [100%] --(E) --(X)
<---> SE indexes |####################| [100%] --(E) --(X)
<---> [M 0.122 Gb] Alloc bare_qpg ( 0.110)
<01s> [04] Static Dielectric Matrix
<01s> [WARNING] Missing non-local pseudopotential contribution
<01s> [X-CG] R(p) Tot o/o(of R) : 86496 190512 100

[ERROR] STOP signal received while in :[04] Static Dielectric Matrix
[ERROR]Mem All. failed. Element WF require 0.00000 [Gb]


I do not know what is wrong with it .

User avatar
Daniele Varsano
Posts: 4198
Joined: Tue Mar 17, 2009 2:23 pm
Contact:

Re: something wrong in running yambo

Post by Daniele Varsano » Wed Dec 11, 2013 7:54 am

Dear Flybird0303,
please when posting in the forum, add in your signature your name and affiliation, this is a rule of the forum.
Next, other rule, when signaling a problem, add in the post your input/output/report/release etc, in general all the information can help to spot the problem. From the few information you post, I cannot see what are you running (system/runlevel/release etc) and it looks that you did not run a setup first. Please run the setup, and next the other run, then post here the r_setup, r_*, l_* and your input file, and if needed also your input for the ground state calculation, so we can have a look on what is going on.
Best,

Daniele
Dr. Daniele Varsano
S3-CNR Institute of Nanoscience and MaX Center, Italy
MaX - Materials design at the Exascale
http://www.nano.cnr.it
http://www.max-centre.eu/

Post Reply