Dear,
I set incar in the following
ISTART=1
#EDIFFG=0.0001
#NSW=0
#IBRION=2
GGA=91
ISMEAR=0
SIGMA=0.1
ENCUT=380
LREAL=T
ICHARG=11
NPAR=1
RWIGS=0.741 1.476 2.138
NEDOS=2000
LORBIT=1
but i get error from out file
running on 64 nodes
distr: one band on 64 nodes, 1 groups
vasp.4.6.35 3Apr08 complex
POSCAR found : 3 types and 112 ions
WARNING: PSMAXN for non-local potential too small
LDA part: xc-table for Ceperly-Alder, standard interpolation
POSCAR, INCAR and KPOINTS ok, starting setup
WARNING: wrap around errors must be expected
FFT: planning ... 1
reading WAVECAR
internal ERROR RSPHER:running out of buffer 0 0
8 1 0
internal ERROR RSPHER:running out of buffer 0 0
8 1 0
internal ERROR RSPHER:running out of buffer 0 0
8 1 0
internal ERROR RSPHER:running out of buffer 0 0
8 1 0
internal ERROR RSPHER:running out of buffer 0 0
8 1 0
I search out in the previous thread but it can not work.
looking forward to your help! Thanks.
Best wishes,
about PDOS error
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lfm2008
- Newbie
- Posts: 2
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about PDOS error
Last edited by lfm2008 on Fri Nov 27, 2009 6:08 am, edited 1 time in total.
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support_vasp
- Global Moderator
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- Joined: Mon Nov 18, 2019 11:00 am
Re: about PDOS error
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