Filename = H:\Lab Reports\3rd Year\Computational Labs\Module 2\Mini project\Hydrogen Peroxide\B3LYP 631G dp frequency pop full nbo.log

Hydrogen Peroxide B3LYP 631G ultrafine frequency
File Name = B3LYP 631G dp frequency pop full nbo
File Type = .log
Calculation Type = FREQ
Calculation Method = RB3LYP
Basis Set = 6-31G(d,p)
Charge = 0
Spin = Singlet
E(RB3LYP) = -151.54319055 a.u.
RMS Gradient Norm = 0.00015397 a.u.
Imaginary Freq = 0
Dipole Moment = 1.7625 Debye
Point Group = C2
Job cpu time:  0 days  0 hours  0 minutes 12.0 seconds.