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木虫 (小有名气)

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[求助] g09 计算莫名停止

如题，在运行G09的时候，总是会莫名停止，最后的输出信息如下：

VARIATIONAL ENERGIES WITH THE FIRST-ORDER WAVEFUNCTION:
DE(Corr)=  -1.6430140    E(Corr)=    -1754.7850780
NORM(A)= 0.12102884D+01
Iteration Nr. 2
**********************
DD1Dir will call FoFDir 6 times, MxPair=    322
NAB= 650 NAA= 325 NBB= 300 NumPrc=  8.
DD1Dir:  Pass 1 NRAB= 161 NRAA=    0 NRBB=    0 NR= 322.
DD1Dir:  Pass 2 NRAB= 161 NRAA=    0 NRBB=    0 NR= 322.
DD1Dir:  Pass 3 NRAB= 161 NRAA=    0 NRBB=    0 NR= 322.
DD1Dir:  Pass 4 NRAB= 161 NRAA=    0 NRBB=    0 NR= 322.
DD1Dir:  Pass 5 NRAB=    6 NRAA= 310 NRBB=    0 NR= 322.
DD1Dir:  Pass 6 NRAB=    0 NRAA= 15 NRBB= 300 NR= 315.
Norm of the A-vectors is  1.2941652D+00 conv= 1.00D-05.
RLE energy=    -1.6922217681
DE(Corr)=  -1.6903938    E(CORR)=    -1754.8324578    Delta=-4.74D-02
NORM(A)= 0.12284308D+01
Iteration Nr. 3
**********************
DD1Dir will call FoFDir 6 times, MxPair=    322
NAB= 650 NAA= 325 NBB= 300 NumPrc=  8.
DD1Dir:  Pass 1 NRAB= 161 NRAA=    0 NRBB=    0 NR= 322.
DD1Dir:  Pass 2 NRAB= 161 NRAA=    0 NRBB=    0 NR= 322.
DD1Dir:  Pass 3 NRAB= 161 NRAA=    0 NRBB=    0 NR= 322.
DD1Dir:  Pass 4 NRAB= 161 NRAA=    0 NRBB=    0 NR= 322.

另外，df -h 查看硬盘使用情况是
@localhost ~]$ df -h /home
Filesystem          Size  Used Avail Use% Mounted on
/dev/cciss/c0d0p3    1.6T  201G  1.3T  14% /home
没有进行磁盘限制（quota)

@localhost ~]$ mount |grep /home
/dev/cciss/c0d0p3 on /home type ext3 (rw)
请教各位是什么原因呢？

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