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beanundersky木蟲 (小有名氣)
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[求助]
磷酸根Discovery
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選用cvff力場(chǎng),結(jié)果出現(xiàn)下面這種情況,不知道該怎么處理,哪位大蝦碰到過這種情況,幫忙看下~~不勝感激 Error: tensor element equals to 0 for a divide operation while executing "vector temp divide $temp $nb_Bij" invoked from within "if {$combination == "sixth_power"} { vector ones fill 1.0 $nType vector ones vectorTranspose $ones vector nb_r vectorTranspose $nb_r ..." (procedure "baseTailCorrection" line 55) invoked from within "baseTailCorrection $vdWTail(cutoff)" invoked from within "if {![info exists vdWTail(energy)]} { set vdWTail(cutoff) $r_cutoff baseTailCorrection $vdWTail(cutoff) } else { if {$r_cutoff != $vdWTa ..." (procedure "fullTailCorrection" line 22) invoked from within "fullTailCorrection $cutoff_onoffsw $printOnly" invoked from within "if {!$printOnly} { fullTailCorrection $cutoff_onoffsw $printOnly puts "NOTE: Pressure and energy tail corrections will be added to all subsequ ..." (procedure "vdWTailCorrection" line 65) invoked from within "vdWTailCorrection 9.50" |

找到一些相關(guān)的精華帖子,希望有用哦~
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