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kaige木蟲 (著名寫手)
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[求助]
gaussian計(jì)算顯示2070錯(cuò)誤 已有1人參與
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大牛幫忙看一下,我把gif文件放進(jìn)Gaussian16顯示2070錯(cuò)誤,打開文檔一看顯示下面內(nèi)容,請(qǐng)幫忙指導(dǎo)一下 %nprocshared=10 Will use up to 10 processors via shared memory. %mem=10GB %chk=E:\G16W\Scratch\RGF-4\1\RGFoptfreq.chk ---------------------------------------------------- #p opt mo62x/defTZVP scrf=(smd,solvent=h2o) em=gd3bj ---------------------------------------------------- QPErr --- A syntax error was detected in the input line. #p opt mo62x/defTZVP scrf=(smd,solvent=h ' Last state= "GCL" TCursr= 3918 LCursr= 7 Error termination via Lnk1e in E:\G16W\l1.exe at Thu Mar 23 15:04:37 2023. Elapsed time: 0 days 0 hours 0 minutes 0.6 seconds. File lengths (MBytes): RWF= 6 Int= 0 D2E= 0 Chk= 1 Scr= 1 |
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