I'm trying to make and run vasp ..
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I'm trying to make and run vasp ..
[root@localhost 1_10_H2Omd]# vasp
vasp.5.2.2 15Apr09 complex
POSCAR found : 2 types and 3 ions
LDA part: xc-table for Pade appr. of Perdew
-----------------------------------------------------------------------------
| |
| W W AA RRRRR N N II N N GGGG !!! |
| W W A A R R NN N II NN N G G !!! |
| W W A A R R N N N II N N N G !!! |
| W WW W AAAAAA RRRRR N N N II N N N G GGG ! |
| WW WW A A R R N NN II N NN G G |
| W W A A R R N N II N N GGGG !!! |
| |
| VASP found 6 degrees of freedom |
| the temperature will equal 2*E(kin)/ (degrees of freedom) |
| this differs from previous releases, where T was 2*E(kin)/(3 NIONS). |
| The new definition is more consistent |
| |
-----------------------------------------------------------------------------
POSCAR, INCAR and KPOINTS ok, starting setup
WARNING: small aliasing (wrap around) errors must be expected
FFT: planning ...( 1 )
reading WAVECAR
WARNING: random wavefunctions but no delay for mixing, default for NELMDL
prediction of wavefunctions initialized
entering main loop
N E dE d eps ncg rms rms(c)
forrtl: severe (174): SIGSEGV, segmentation fault occurred
Stack trace terminated abnormally.
[root@localhost 1_10_H2Omd]#
My PC's CPU is Nehalem (Core i7-2600k 3.4GHz) have 8cores.
Single system in Vmware .
Number of processors =2
Core per processors =2
I'm trying with makefile.linux_ifc_P4 and my vasp version is 5.2
and compiler is intel fortran composerXE 2011.8.273
BLAS = /usr/lib/libblas.so
Sorry about my poor knowledge and English....
and Thank you for reading.
vasp.5.2.2 15Apr09 complex
POSCAR found : 2 types and 3 ions
LDA part: xc-table for Pade appr. of Perdew
-----------------------------------------------------------------------------
| |
| W W AA RRRRR N N II N N GGGG !!! |
| W W A A R R NN N II NN N G G !!! |
| W W A A R R N N N II N N N G !!! |
| W WW W AAAAAA RRRRR N N N II N N N G GGG ! |
| WW WW A A R R N NN II N NN G G |
| W W A A R R N N II N N GGGG !!! |
| |
| VASP found 6 degrees of freedom |
| the temperature will equal 2*E(kin)/ (degrees of freedom) |
| this differs from previous releases, where T was 2*E(kin)/(3 NIONS). |
| The new definition is more consistent |
| |
-----------------------------------------------------------------------------
POSCAR, INCAR and KPOINTS ok, starting setup
WARNING: small aliasing (wrap around) errors must be expected
FFT: planning ...( 1 )
reading WAVECAR
WARNING: random wavefunctions but no delay for mixing, default for NELMDL
prediction of wavefunctions initialized
entering main loop
N E dE d eps ncg rms rms(c)
forrtl: severe (174): SIGSEGV, segmentation fault occurred
Stack trace terminated abnormally.
[root@localhost 1_10_H2Omd]#
My PC's CPU is Nehalem (Core i7-2600k 3.4GHz) have 8cores.
Single system in Vmware .
Number of processors =2
Core per processors =2
I'm trying with makefile.linux_ifc_P4 and my vasp version is 5.2
and compiler is intel fortran composerXE 2011.8.273
BLAS = /usr/lib/libblas.so
Sorry about my poor knowledge and English....
and Thank you for reading.
Last edited by haneol815 on Mon Jan 16, 2012 2:47 pm, edited 1 time in total.
-
- Global Moderator
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Re: I'm trying to make and run 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