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2009
Segala, M. ; Chong, D. P. An Evaluation Of Exchange-Correlation Functionals For The Calculations Of The Ionization Energies For Atoms And Molecules. Journal of Electron Spectroscopy and Related Phenomena 2009, 171, 18-23.
Munha, R. F. ; Veiros, L. F. ; Duarte, M. T. ; Fryzuk, M. D. ; Martins, A. M. Synthesis And Structural Studies Of Amido, Hydrazido And Imido Zirconium(Iv) Complexes Incorporating A Diamido/diamine Cyclam-Based Ligand. Dalton Transactions 2009, 7494-7508.
2006
Spencer, L. P. ; Beddie, C. ; Hall, M. B. ; Fryzuk, M. D. Synthesis, Reactivity, And Dft Studies Of Tantalum Complexes Incorporating Diamido-N-Heterocyclic Carbene Ligands. Facile Endocyclic C-H Bond Activation. Journal of the American Chemical Society 2006, 128, 12531-12543.
2005
Makeiff, D. A. ; Sherman, J. C. A Six-Bowl Carceplex That Entraps Seven Guest Molecules. Journal of the American Chemical Society 2005, 127, 12363-12367.
2004
Takahata, Y. ; Chong, D. P. ; Segala, M. Is Ham/3 (Hydrogenic Atoms In Molecules, Version 3) A Semiempirical Version Of Dft (Density Functional Theory) For Ionization Processes?. Journal of the Brazilian Chemical Society 2004, 15, 282-291.
Tian, W. Q. ; Wang*, Y. A. Mechanisms Of Staudinger Reactions Within Density Functional Theory. J. Org. Chem. 2004, 69, 4299-4308.
2002
Mungaroo, R. ; Sherman, J. C. Formation Of A Tris-Capsule And A Tris-Carceplex From A Cyclic Six-Bowl Assembly. Chemical Communications 2002, 1672-1673.
Chong, D. P. ; Gritsenko, O. V. ; Baerends, E. J. Interpretation Of The Kohn-Sham Orbital Energies As Approximate Vertical Ionization Potentials. Journal of Chemical Physics 2002, 116, 1760-1772.
2001
Shapley, W. A. ; Chong, D. P. Pw86-Pw91 Density Functional Calculation Of Vertical Ionization Potentials: Some Implications For Present-Day Functionals. International Journal of Quantum Chemistry 2001, 81, 34-52.
1998
Chapman, R. G. ; Olovsson, G. ; Trotter, J. ; Sherman, J. C. Crystal Structure And Thermodynamics Of Reversible Molecular Capsules. Journal of the American Chemical Society 1998, 120, 6252-6260.
Chapman, R. G. ; Olovsson, G. ; Trotter, J. ; Sherman, J. C. Crystal Structure And Thermodynamics Of Reversible Molecular Capsules. Journal of the American Chemical Society 1998, 120, 6252-6260.
Chapman, R. G. ; Sherman, J. C. Reversible Molecular Capsules Composed Of Two Cavitands Linked Via An Assortment Of Charged-Hydrogen Bonds And Covalent Bonds. Journal of the American Chemical Society 1998, 120, 9818-9826.