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小木虫论坛-学术科研互动平台 » 计算模拟区 » 量子化学 » Gamess/Q-Chem » 【求助】Gamess 安装报错？
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ywfsxh

金虫 (正式写手)

[交流] 【求助】Gamess 安装报错？

安装时出现如下错误：试图在单机上运行 exam21

ERROR OPENING NEW FILE PUNCH,
ASSIGNED TO EXPLICIT FILE NAME ～/gamess/tests/exam21.dat,
PLEASE CHECK THE -SETENV- FILE ASSIGNMENTS IN YOUR -RUNGMS- SCRIPT.
EXECUTION OF GAMESS TERMINATED -ABNORMALLY- AT Sun Jan 23 12:10:13 2011
STEP CPU TIME =     0.00 TOTAL CPU TIME =        0.0 (    0.0 MIN)
TOTAL WALL CLOCK TIME=        0.0 SECONDS, CPU UTILIZATION IS 100.00%
DDI Process 0: error code 911
ddikick.x: application process 0 quit unexpectedly.
ddikick.x: Fatal error detected.
The error is most likely to be in the application, so check for
input errors, disk space, memory needs, application bugs, etc.
ddikick.x will now clean up all processes, and exit...
ddikick.x: Sending kill signal to DDI processes.
ddikick.x: Execution terminated due to error(s).
unset echo
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1楼 2011-01-23 19:13:58
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beefly

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ywfsxh(金币+1): 2011-01-24 20:13:05
ywfsxh(金币+1): 2011-01-27 04:51:37
375642546(金币+3): 谢谢! 2011-04-29 15:31:16
不能有同名的.dat文件，计算前需要先删除
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5楼2011-01-24 00:37:21
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snoopyzhao

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ywfsxh(金币+1): 2011-01-23 20:06:51
提示上写得很清楚啊……

PLEASE CHECK THE -SETENV- FILE ASSIGNMENTS IN YOUR -RUNGMS- SCRIPT.

仔细看一下与 punch file 相关的设置……
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2楼2011-01-23 19:56:20
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ywfsxh

金虫 (正式写手)

该了之后，包下面到错误

引用回帖:
Originally posted by snoopyzhao at 2011-01-23 19:56:20:
提示上写得很清楚啊……

PLEASE CHECK THE -SETENV- FILE ASSIGNMENTS IN YOUR -RUNGMS- SCRIPT.

仔细看一下与 punch file 相关的设置……

DDI Process 0: shmget returned an error.
Error EINVAL: Attempting to create 160525368 bytes of shared memory.
Check system limits on the size of SysV shared memory segments.

The file ~/gamess/ddi/readme.ddi contains information on how to display
the current SystemV memory settings, and how to increase their sizes.
Increasing the setting requires the root password, and usually a sytem reboot.

DDI Process 0: error code 911
ddikick.x: application process 0 quit unexpectedly.
ddikick.x: Fatal error detected.
The error is most likely to be in the application, so check for
input errors, disk space, memory needs, application bugs, etc.
ddikick.x will now clean up all processes, and exit...
ddikick.x: Sending kill signal to DDI processes.
ddikick.x: Execution terminated due to error(s).
unset echo
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3楼2011-01-23 20:07:59
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snoopyzhao

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ywfsxh(金币+1): 2011-04-25 13:17:06
375642546(金币+2): 谢谢！ 2011-04-29 15:30:58
引用回帖:
Originally posted by ywfsxh at 2011-01-23 20:07:59:

DDI Process 0: shmget returned an error.
Error EINVAL: Attempting to create 160525368 bytes of shared memory.
Check system limits on the size of SysV shared memory segments.

The file ~/ga ...

看一下 http://muchong.com/bbs/viewthread.php?tid=2385152&fpage=1 中 alan8410 的回复对你有没有帮助

另外，你也可以看一下提示信息上提到的那个文件……
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4楼2011-01-23 20:16:13
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