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[求助] 量化计算几天后出现错误终止，新手求助

输入文件：
%chk=yjx051-130807.chk
%mem=100MW
%nproc=4
# opt b3lyp/lanl2dz geom=connectivity

yjx051-130807
……

出错时，输出文件的末尾：
Harris functional with IExCor=  402 diagonalized for initial guess.
ExpMin= 6.30D-02 ExpMax= 7.82D+03 ExpMxC= 2.73D+02 IAcc=2 IRadAn=       0 AccDes= 0.00D+00
HarFok:  IExCor=  402 AccDes= 0.00D+00 IRadAn=       0 IDoV= 1
ScaDFX=  1.000000  1.000000  1.000000  1.000000
Defaulting to unpruned grid for atomic number  50.
Defaulting to unpruned grid for atomic number  50.
Defaulting to unpruned grid for atomic number  50.
Defaulting to unpruned grid for atomic number  50.
FoFCou: FMM=F IPFlag=          0 FMFlag=    100000 FMFlg1=       2001
      NFxFlg=          0 DoJE=T BraDBF=F KetDBF=T FulRan=T
      Omega=  0.000000  0.000000  1.000000  0.000000  0.000000 ICntrl=    500 IOpCl=  0
      NMat0= 1 NMatS0= 1 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0
      I1Cent=          4 NGrid=          0.
Petite list used in FoFCou.
Requested convergence on RMS density matrix=1.00D-08 within 128 cycles.
Requested convergence on MAX density matrix=1.00D-06.
Requested convergence on          energy=1.00D-06.
No special actions if energy rises.
Integral accuracy reduced to 1.0D-05 until final iterations.
Defaulting to unpruned grid for atomic number  50.
Defaulting to unpruned grid for atomic number  50.
Defaulting to unpruned grid for atomic number  50.
Defaulting to unpruned grid for atomic number  50.
Initial convergence to 1.0D-05 achieved.  Increase integral accuracy.
SCF Done:  E(RB3LYP) =  -1629.41071421    A.U. after 15 cycles
         Convg  = 0.5454D-08          -V/T =  2.0077
1 Symmetry operations used in ECPInt.
ECPInt:  NShTT= 43956 NPrTT=  313705 LenC2= 37885 LenP2D=  138934.
LDataN:  DoStor=T MaxTD1= 5 Len=  102