Publications

Bühl, M.; Reimann, C.; Pantazis, D. A.; Bredow, T.; Neese, F. Geometries of Third-Row Transition-Metal Complexes from Density-Functional Theory. Journal of Chemical Theory and Computation 2008, 4, 1449–1459.

Pantazis, D. A.; Chen, X.-Y.; Landis, C. R.; Neese, F. All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal Atoms. Journal of Chemical Theory and Computation 2008, 4, 908–919.

Pantazis, D. A.; McGrady, J. E.; Besora, M.; Maseras, F.; Etienne, M. On the Origin of α- and β-Agostic Distortions in Early-Transition-Metal Alkyl Complexes. Organometallics 2008, 27, 1128–1134.

Boulho, C.; Keys, T.; Coppel, Y.; Vendier, L.; Etienne, M.; Locati, A.; Bessac, F.; Maseras, F.; Pantazis, D. A.; McGrady, J. E. C−C Coupling Constants, J_CC, Are Reliable Probes for α-C−C Agostic Structures. Organometallics 2008, 28, 940–943.

Butts, C. P.; Green, M.; Hooper, T. N.; Kilby, R. J.; McGrady, J. E.; Pantazis, D. A.; Russell, C. A. 1,2-Diphosphinobenzene as a Synthon for the 1,2,3-Triphospha- and 2-Arsa-1,3-Diphosphaindenyl Anions and a Stable Organo Derivative of the P₈ Unit of Hittorf’s Phosphorus. Chemical Communications 2008, No. 7, 856–858.

Fish, C.; Green, M.; Kilby, R. J.; McGrady, J. E.; Pantazis, D. A.; Russell, C. A. Promotion of Phosphaalkyne Cyclooligomerisation by a Sb(v) to Sb(Iii)Redox Process. Dalton Transactions 2008, No. 28, 3753–3758.

Pantazis, D. A.; Murillo, C. A.; McGrady, J. E. A Re-Evaluation of the Two-Step Spin Crossover in the Trinuclear Cation [Co₃(Dipyridylamido)₄Cl₂]⁺. Dalton Transactions 2008, No. 5, 608–614.