Filename = \\icnas2.cc.ic.ac.uk\av4217\Year 2\Inorganic Comp\BH3_sym1_opt_av4217.log

BH3 optimisation
File Name = BH3_sym1_opt_av4217
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = 6-31G(d,p)
Charge = 0
Spin = Singlet
E(RB3LYP) = -26.61532364 a.u.
RMS Gradient Norm = 0.00000528 a.u.
Imaginary Freq = 
Dipole Moment = 0.0000 Debye
Point Group = D3H
Job cpu time:       0 days  0 hours  0 minutes 16.0 seconds.