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error in parallel runing vasp.5.2.11

Posted: Tue Apr 12, 2011 12:25 am
by xskong
When i runing vasp, i found this error. why?
24 F= -.22196934E+03 E0= -.22197326E+03 d E =-.400095E-03 mag= 0.1612
ZBRENT: can't locate minimum, use default step
trial-energy change: -0.000400 1 .order -0.000556 -0.000559 -0.000553
step: 0.4444(harm= 9.9650) dis= 0.00096 next Energy= -221.994021 (dE=-0.251E-01)
bond charge predicted
N E dE d eps ncg rms rms(c)
DAV: 1 -0.221970827560E+03 -0.14608E-02 -0.53939E-02206496 0.741E-01 0.110E-01
RMM: 2 -0.221972529214E+03 -0.17017E-02 -0.20007E-03208929 0.224E-01 0.752E-01
RMM: 3 -0.221971254138E+03 0.12751E-02 -0.40130E-04146366 0.104E-01 0.197E-01
RMM: 4 -0.221971003791E+03 0.25035E-03 -0.82758E-05104239 0.493E-02 0.149E-01
RMM: 5 -0.221971166912E+03 -0.16312E-03 -0.13528E-04118893 0.523E-02 0.282E-01
RMM: 6 -0.221970966721E+03 0.20019E-03 -0.12650E-04112509 0.617E-02 0.917E-02
RMM: 7 -0.221970961328E+03 0.53928E-05 -0.51591E-05103746 0.312E-02
25 F= -.22197096E+03 E0= -.22197489E+03 d E =-.201994E-02 mag= 0.1748
curvature: -0.34 expect dE=-0.145E-02 dE for cont linesearch -0.140E-02
ZBRENT: increasing intervall
opt : 1.1111 next Energy= -221.973787 (dE=-0.485E-02)
bond charge predicted
N E dE d eps ncg rms rms(c)
cu033:15600: dapl_post_req resource ERR: dtos pending = 432, max_dtos 432, max_cb 433 hd 298 tl 299
rank 9 in job 1 cu033-ib_57762 caused collective abort of all ranks
exit status of rank 9: return code 254

Re: error in parallel runing vasp.5.2.11

Posted: Tue Sep 10, 2024 2:09 pm
by support_vasp

Hi,

We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.

Best wishes,

VASP