Filename = F:/3rd year computational lab/Module 2/BH3 molecule/BH3 optimisation.log

BH3 Optimisation
File Name = BH3 optimisation
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = 3-21G
Charge = 0
Spin = Singlet
E(RB3LYP) = -26.46226338 a.u.
RMS Gradient Norm = 0.00010672 a.u.
Imaginary Freq = 
Dipole Moment = 0.0000 Debye
Point Group = D3H
Job cpu time:  0 days  0 hours  1 minutes 30.0 seconds.