... Ustynyuk Yu.A., Laikov D.N., Lunin V.V. Activation of CH 4 and H 2 molecules by cationic zirconium(IV) complexes: a DFT study. ... Laikov D.N. DFT study of [Cp ’ 2 ZrCH 3 ]+[CH 3 B(C 6 F 5 ) 3 ] - ion pair formation. ... Ustynyuk Yu.A., Laikov D.N., Lunin V.V. Activation of C-H bonds in C 1 -C 3 alkanes by titanium(IV) and zirconium(IV) cationic complexes: a DFT study. ... Ustynyuk Yu.A., Laikov D.N., Lunin V.V. DFT study of the mechanism of alkane hydrogenolysis by transition metal hydrides. ...