Filename = \\ic.ac.uk\homes\sw2711\Desktop\y3 lab\3rdyearlab\SW_bh3_opt.log BH3 optimisation File Name = SW_bh3_opt File Type = .log Calculation Type = FOPT Calculation Method = RB3LYP Basis Set = 3-21G Charge = 0 Spin = Singlet E(RB3LYP) = -26.46226429 a.u. RMS Gradient Norm = 0.00008851 a.u. Imaginary Freq = Dipole Moment = 0.0003 Debye Point Group = CS Job cpu time: 0 days 0 hours 0 minutes 20.0 seconds.