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yanzilai

铜虫 (初入文坛)

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虫号: 744617
注册: 2009-04-09
性别: GG
专业: 半导体材料

[求助] VASP计算完报错

每次用vasp计算完都会出现以下报错，各位知道这个报错要紧不：

running on 4 nodes
distr:  one band on 1 nodes, 4 groups
vasp.5.2.2 15Apr09 complex
POSCAR found :  3 types and  107 ions
LDA part: xc-table for Pade appr. of Perdew
POSCAR found :  3 types and  107 ions
POSCAR, INCAR and KPOINTS ok, starting setup
FFT: planning ...(          1 )
reading WAVECAR
entering main loop
   N    E                   dE          d eps    ncg    rms       rms(c)
DAV: 1    0.375887089011E+04 0.37589E+04 -0.18020E+05  3560 0.104E+03
DAV: 2 -0.156456008421E+03 -0.39153E+04 -0.37836E+04  4920 0.232E+02
DAV: 3 -0.754767430952E+03 -0.59831E+03 -0.58350E+03  4016 0.943E+01
DAV: 4 -0.782162529720E+03 -0.27395E+02 -0.27241E+02  4560 0.221E+01
DAV: 5 -0.783341435480E+03 -0.11789E+01 -0.11758E+01  5352 0.429E+00 0.328E+01
RMM: 6 -0.750433834984E+03 0.32908E+02 -0.21157E+02  4396 0.140E+01 0.123E+01
RMM: 7 -0.744495569853E+03 0.59383E+01 -0.16139E+01  4002 0.473E+00 0.643E+00
RMM: 8 -0.743617346453E+03 0.87822E+00 -0.11204E+01  3997 0.325E+00 0.237E+00
RMM: 9 -0.743720772925E+03 -0.10343E+00 -0.58638E+00  4507 0.234E+00 0.240E+00
RMM:  10 -0.743334879166E+03 0.38589E+00 -0.71529E-01  4284 0.980E-01 0.766E-01
RMM:  11 -0.743335885492E+03 -0.10063E-02 -0.60846E-01  4735 0.640E-01 0.437E-01
RMM:  12 -0.743322551002E+03 0.13334E-01 -0.30491E-02  4224 0.211E-01 0.166E-01
RMM:  13 -0.743324149440E+03 -0.15984E-02 -0.20946E-02  4755 0.127E-01 0.802E-02
RMM:  14 -0.743327922869E+03 -0.37734E-02 -0.16456E-03  4250 0.414E-02 0.556E-02
RMM:  15 -0.743330163788E+03 -0.22409E-02 -0.10727E-03  4295 0.305E-02 0.216E-02
RMM:  16 -0.743332062905E+03 -0.18991E-02 -0.30532E-04  3858 0.164E-02 0.128E-02
RMM:  17 -0.743332884216E+03 -0.82131E-03 -0.20950E-04  4248 0.122E-02 0.903E-03
RMM:  18 -0.743333286260E+03 -0.40204E-03 -0.67770E-05  3378 0.786E-03 0.162E-02
RMM:  19 -0.743333454216E+03 -0.16796E-03 -0.15630E-04  3801 0.123E-02 0.579E-03
RMM:  20 -0.743333551842E+03 -0.97626E-04 -0.20013E-05  2763 0.485E-03 0.865E-03
RMM:  21 -0.743333639813E+03 -0.87971E-04 -0.16298E-05  2657 0.560E-03 0.191E-03
RMM:  22 -0.743333687327E+03 -0.47514E-04 -0.12258E-05  2562 0.355E-03 0.213E-03
RMM:  23 -0.743333744713E+03 -0.57386E-04 -0.50961E-06  2170 0.238E-03 0.216E-03
RMM:  24 -0.743333764295E+03 -0.19582E-04 -0.18673E-06  1736 0.161E-03 0.176E-03
RMM:  25 -0.743333771405E+03 -0.71093E-05 -0.89424E-07  1455 0.140E-03
1 F= -.74333377E+03 E0= -.74333377E+03  d E =0.000000E+00
writing wavefunctions
FORTRAN STOP
FORTRAN STOP
FORTRAN STOP
FORTRAN STOP

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