Filename = //icnas2.cc.ic.ac.uk/jl10312/Desktop/3rdYearLab/JL_GaBr3_pp_optimisation.log.log

GaBr3 Optimsation using Pseudo-potentials
File Name = JL_GaBr3_pp_optimisation.log
File Type = .log
Calculation Type = FOPT
Calculation Method = RB3LYP
Basis Set = LANL2DZ
Charge = 0
Spin = Singlet
E(RB3LYP) = -41.70082770 a.u.
RMS Gradient Norm = 0.00000016 a.u.
Imaginary Freq = 
Dipole Moment = 0.0000 Debye
Point Group = D3H
Job cpu time:       0 days  0 hours  0 minutes 26.0 seconds.