- 156 名前：あるケミストさん [04/01/01 10:30]
- >>155
ttp://www.gaussian.com/g_ur/k_scf.htm
VShift[=N]
Shift orbital energies by N*0.001 (i.e., N millihartrees); N defaults to 100.
This option disables automatic archiving.
N=-1 disables level shifting; NoVShift is equivalent to this setting.
みると１００みたいだなー
