网问答>>Gaussian view打开chk文件计算静电势点new cube出现新窗口怎么进行下一步?
问题
未解决

Gaussian view打开chk文件计算静电势点new cube出现新窗口怎么进行下一步?

时间:2024-04-21 13:58:23
Executing Formchk ="D:G09Wformchk.exe" /3 "E:jiegouF-ele.chk" "D:G09WScratchgv4_21_2024_09_53_40ey026.fch" Read checkpoint file E:jiegouF-ele.chk Write formatted file D:G09WScratchgv4_21_2024_09_53_40ey026.fch Coordinates translated and rotated. Coordinates match /B/ after translation and rotation. Rotating derivatives, DoTrsp=T IDiff= 1 LEDeriv= 20789 LFDPrp= 0 LDFDPr= 0.Formchk Job Completed (PID = 209c, status = 0)Executing Gaussian Cubegen ="D:G09Wcubegen.exe" 0 density=scf "D:G09WScratchgv4_21_2024_09_53_40ey026.fch" "D:G09WScratchgv4_21_2024_09_53_40mgbuj.cub" -2 hCubegen Job Completed (PID = bb0, status = -1073741510)
本类最有帮助
Copyright © 2008-2013 www.wangwenda.com All rights reserved.冀ICP备12000710号-1
投诉邮箱: