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标题: MS用DMOl3优化时，优化失败，下载结果如下，遇到这种如何解决呀 [打印本页]
作者
Author: yym    时间: 2021-3-31 09:14
标题: MS用DMOl3优化时，优化失败，下载结果如下，遇到这种如何解决呀
file:///C:/Program%20Files%20(x86)/BIOVIA/Materials%20Studio%2018.1/share/Graphics/matlog.gif | Project Log
TimeModuleTypeMessage Text
[size=-1]2021/03/31@08:13:25
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[size=-1]2021/03/31@08:13:40
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).car as download target.
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[size=-1]Failed to download file: FeO__1_0_0_.car
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[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).hessian as download target.
[size=-1]2021/03/31@08:13:40
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.hessian
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).tpotl as download target.
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Failed to download file: FeO__1_0_0_.tpotl
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).tpdensk as download target.
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.tpdensk
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0)_opt.summ as download target.
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Failed to download file: FeO__1_0_0__opt.summ
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).arc as download target.
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Failed to download file: FeO__1_0_0_.arc
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).cosmo as download target.
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Failed to download file: FeO__1_0_0_.cosmo
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).sdf as download target.
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Failed to download file: FeO__1_0_0_.sdf
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).outmol as download target.
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.outmol
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).grad as download target.
[size=-1]2021/03/31@08:13:41
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Failed to download file: FeO__1_0_0_.grad
[size=-1]2021/03/31@08:13:50
[size=-1]Message Box
[size=-1]WARN
[size=-1]Reconnected to 3 job(s), 3 of which are still running.
[size=-1]2021/03/31@08:14:07
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).car as download target.
[size=-1]2021/03/31@08:14:07
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[size=-1]Failed to download file: FeO__1_0_0_.car
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[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).hessian as download target.
[size=-1]2021/03/31@08:14:07
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
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[size=-1]Failed to download file: FeO__1_0_0_.hessian
[size=-1]2021/03/31@08:14:07
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).tpotl as download target.
[size=-1]2021/03/31@08:14:07
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.tpotl
[size=-1]2021/03/31@08:14:07
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).tpdensk as download target.
[size=-1]2021/03/31@08:14:07
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.tpdensk
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0)_opt.summ as download target.
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0__opt.summ
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).arc as download target.
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.arc
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).cosmo as download target.
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.cosmo
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).sdf as download target.
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.sdf
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).outmol as download target.
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.outmol
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).grad as download target.
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.grad
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Files not removed from server due to previous errors.
[size=-1]2021/03/31@08:14:08
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]As instructed, files have been left on remote server, these may need to be manually archived.
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).car as download target.
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.car
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).hessian as download target.
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.hessian
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).tpotl as download target.
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.tpotl
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).tpdensk as download target.
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.tpdensk
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0)_opt.summ as download target.
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0__opt.summ
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).arc as download target.
[size=-1]2021/03/31@09:10:57
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.arc
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).cosmo as download target.
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.cosmo
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).sdf as download target.
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.sdf
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).outmol as download target.
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.outmol
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Error opening file D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)\FeO (1 0 0).grad as download target.
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]Failed to download file: FeO__1_0_0_.grad
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]ERROR
[size=-1]Files not removed from server due to previous errors.
[size=-1]2021/03/31@09:10:58
[size=-1][43VDJ] - FeO (1 0 0) DMol3 GeomOpt
[size=-1]WARN
[size=-1]As instructed, files have been left on remote server, these may need to be manually archived.

作者
Author: 泡泡媛    时间: 2021-3-31 09:25
这个信息真的看不出来什么，建议你把计算的参数全都贴出来看看，还有之前不是有大佬给你建议考虑它的磁性么，可以先设定一下，我看你的问题都快一个星期了还没有解决，大家给你的建议你要采纳啊
作者
Author: ABetaCarw    时间: 2021-3-31 10:19
你给出的报错信息 大概相当于高斯报错时候的2070界面。只能证明你确实遇到了报错，而不能告知任何可能的原因。或许你可以打开报错任务的txt文件拖到最后看看软件给你的提示
作者
Author: 完美捉迷藏    时间: 2021-3-31 10:32
本帖最后由 完美捉迷藏 于 2021-3-31 10:33 编辑

你是不是把D:\Untitled_Files\Documents\FeO (1 0 0) DMol3 GeomOpt (4)，这个位置的文件名修改，或者挪移文件夹到其他地方了
作者
Author: lina199904    时间: 2022-4-2 12:31
请问一下你最后是怎么解决的，我也遇到了相同的问题



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