Filename = H:\desktop\3rdyearlab\NH3_optimisation_maw210.log

NH3 optimisation
File Name = NH3_optimisation_maw210
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = 6-31G(d,p)
Charge = 0
Spin = Singlet
E(RB3LYP) = -56.55776856 a.u.
RMS Gradient Norm = 0.00000885 a.u.
Imaginary Freq = 
Dipole Moment = 1.8464 Debye
Point Group = C1
Job cpu time:  0 days  0 hours  0 minutes 10.0 seconds.