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SunnyRain0.0金虫 (正式写手)
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[求助]
Discover 结构优化失败,求指点
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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" Total time used by DISCOVER: 0.24 secs Completion date: Tue Jul 23 07:27:16 2013 Exiting Discover: An ERROR has occurred! 求高手指点这是什么原因导致的错误 |
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