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kuyedexiao

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[ÇóÖú] Gaussian ¼ÆËãÈýÖØÌ¬´íÎóÖÕÖ¹ ÒÑÓÐ1È˲ÎÓë

Iteration     1 Dimension    12 NMult    12
FoFJK:  IHMeth= 1 ICntrl=     0 DoSepK=T KAlg= 1 I1Cent= 0 FoldK=F
CoulSu:  requested number of processors reduced to:  16 ShMem   1 Linda.
Insufficient memory for a single shell combination in PrsMar called from Prism/PrismC:
LenV=      938403 MaxCom=        -148
Error termination via Lnk1e in /home/zhangcairong/soft/g09/l914.exe at Sun Nov 15 08:25:15 2015.
Job cpu time:285 days 14 hours 52 minutes 50.0 seconds.
File lengths (MBytes):  RWF=  16395 Int=      0 D2E=      0 Chk=    139 Scr=      2
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  • ¸½¼þ 1 : BP.log
  • 2015-11-16 10:17:45, 96.75 K

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kuyedexiao

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%chk=BP.chk
%mem=12000MB
%nprocshared=32
Will use up to   32 processors via shared memory.
----------------------------------------------------------------------
#td=(triplets,nstates=3) scrf=(smd,solvent=chloroform) cam-b3lyp/6-31+
g(d,p) scf=(xqc,maxconventionalcycles=500)
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kuyedexiao: ½ð±Ò+20, ¡ï¡ï¡ï¡ï¡ï×î¼Ñ´ð°¸ 2015-11-17 10:39:29
Insufficient memory for a single shell combination in PrsMar called from Prism/PrismC:
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