Publications of Dimitrios A. Pantazis

Journal Article (133)

2007
Journal Article
Pantazis, D. A.; McGrady, J. E.; Maseras, F.; Etienne, M. Critical Role of the Correlation Functional in DFT Descriptions of an Agostic Niobium Complex. Journal of Chemical Theory and Computation 2007, 3, 1329–1336.
Journal Article
Derrah, E. J.; Pantazis, D. A.; McDonald, R.; Rosenberg, L. A Highly Reactive Ruthenium Phosphido Complex Exhibiting Ru−P π-Bonding. Organometallics 2007, 26, 1473–1482.
2006
Journal Article
Christmann, U.; Pantazis, D. A.; Benet-Buchholz, J.; McGrady, J. E.; Maseras, F.; Vilar, R. Synthesis and Computational Studies of Palladium(I) Dimers Pd2X2(PtBu2Ph)2 (X = Br, I):  Phenyl Versus Halide Bridging Modes. Organometallics 2006, 25, 5990–5995.
Journal Article
Fish, C.; Green, M.; Jeffery, J. C.; Kilby, R. J.; Lynam, J. M.; McGrady, J. E.; Pantazis, D. A.; Russell, C. A.; Willans, C. E. A Main‐Group Analogue of Housene: The Subtle Influence of the Inert‐Pair Effect in Group 15 Clusters. Angewandte Chemie International Edition 2006, 45, 6685–6689.
Journal Article
Fish, C.; Green, M.; Kilby, R. J.; Lynam, J. M.; McGrady, J. E.; Pantazis, D. A.; Russell, C. A.; Whitwood, A. C.; Willans, C. E. A New Reaction Pathway in Organophosphorus Chemistry: Competing SN2 and AE′ Pathways for Nucleophilic Attack at a Phosphorus–Carbon Cage Compound. Angewandte Chemie International Edition 2006, 45, 3628–3631.
Journal Article
Christmann, U.; Pantazis, D. A.; Benet-Buchholz, J.; McGrady, J. E.; Maseras, F.; Vilar, R. Experimental and Theoretical Investigations of New Dinuclear Palladium Complexes as Precatalysts for the Amination of Aryl Chlorides. Journal of the American Chemical Society 2006, 128, 6376–6390.
Journal Article
Pantazis, D. A.; McGrady, J. E. A Three-State Model for the Polymorphism in Linear Tricobalt Compounds. Journal of the American Chemical Society 2006, 128, 4128–4135.
Journal Article
Fish, C.; Green, M.; Kilby, R. J.; Lynam, J. M.; McGrady, J. E.; Pantazis, D. A.; Russell, C. A.; Willans, C. E. Cationic Phosphorus–Carbon–Pnictogen Cages Isolobal to [C5R5]+. Chemical Communications 2006, No. 13, 1375–1377.
2005
Journal Article
McGrady, J. E.; Pantazis, D. A. Bistability in Metal Cluster Compounds. Chemtracts 2005, 18, 629–636.
2004
Journal Article
Pantazis, D. A.; McGrady, J. E.; Lynam, J. M.; Russell, C. A.; Green, M. Structure and Bonding in the Isoelectronic Series CnHnP5−n+: is Phosphorus a Carbon Copy? Dalton Transactions 2004, No. 14, 2080–2086.
Journal Article
Pantazis, D. A.; Tsipis, A. C.; Tsipis, C. A. Theoretical Study on the Mechanism of Reaction of Ground-State Fe Atoms with Carbon Dioxide. Collection of Czechoslovak Chemical Communications 2004, 69, 13–33.
2003
Journal Article
Pantazis, D. A.; McGrady, J. E. On the Nature of the Bonding in 1:1 Adducts of O2. Inorganic Chemistry 2003, 42, 7734–7736.
2002
Journal Article
Pantazis, D. A.; Tsipis, A. C.; Tsipis, C. A. Ab Initio Quantum Chemical Study of the Coordination Preferences and Catalytic Role of Cu+ Ions in the Dehydration Reactions of Hydroxyformaldoxime Conformers and the Oxidation of HCN to Hydroxyformaldoxime by Hydrogen Peroxide. The Journal of Physical Chemistry A 2002, 106, 1425–1440.

Book Chapter (8)

2021
Book Chapter
Pantazis, D. A. Biological Water Splitting. In Energy, Environment and New Materials: Hydrogen Production and Energy Transition (Vol. 1); Van de Voorde, M., Ed.; Van de Voorde, M., Series ed.; de Gruyter: Berlin, 2021; pp 427–468.
Book Chapter
Pantazis, D. A. Natural and Artificial Photosynthesis. In Solar-to-Chemical Conversion: Photocatalytic and Photoelectrochemcial Processes; Sun, H., Ed.; Sun, H., Series ed.; Wiley-VCH GmbH: Weinheim, 2021; pp 41–76.
2019
Book Chapter
Krewald, V.; Pantazis, D. A. Applications of the Density Matrix Renormalization Group to Exchange-Coupled Transition Metal Systems. In Transition Metals in Coordination Environments. Vol. 29 of Series: Challenges and Advances in Computatonal Chemistry and Physics; Broclawik, E., Borowski, T., Radoń, M., Eds.; Broclawik, E., Borowski, T., Radoń, M., Series Eds.; Springer: Cham, 2019; Vol. 29, pp 91–120.
2016
Book Chapter
Krewald, V.; Retegan, M.; Pantazis, D. A. Principles of Natural Photosynthesis; Tüysüz, H., Chan, C. K., Eds.; Tüysüz, H., Chan, C. K., Series Eds.; Topics in Current Chemistry 371-Solar Energy for Fuels; Springer: Cham, 2016; Vol. 371, pp 23–48.
2014
Book Chapter
Pantazis, D. A.; Cox, N.; Lubitz, W.; Neese, F. Oxygen‐Evolving Photosystem II. In Encyclopedia of Inorganic and Bioinorganic Chemistry; Scott, R. A., Messerschmid, A., Nicolet, Y., Eds.; Scott, R. A., Messerschmid, A., Nicolet, Y., Series Eds.; John Wiley & Sons: Hoboken, 2014.
2012
Book Chapter
DeBeer, S.; van Gastel, M.; Bill, E.; Ye, S.; Petrenko, T.; Pantazis, D. A.; Neese, F. 4.5 Challenges in Molecular Energy Research. In Chemical Energy Storage; Schlögl, R., Ed.; Schlögl, R., Series ed.; Walter De Gruyter: Berlin, 2012.
2010
Book Chapter
Neese, F.; Ames, W.; Christian, G.; Kampa, M.; Liakos, D. G.; Pantazis, D. A.; Roemelt, M.; Surawatanawong, P.; Shengfa, Y. E. Dealing with Complexity in Open-Shell Transition Metal Chemistry from a Theoretical Perspective: Reaction Pathways, Bonding, Spectroscopy, And Magnetic Properties; van Eldik, R., Harvey, J., Eds.; van Eldik, R., Harvey, J., Series Eds.; Advances in Inorganic Chemistry; Elsevier: Amsterdam, 2010; Vol. 62, pp 301–349.
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