20) Mark A. Iron, “Density Functional Theory and Transition Metals Reactions – Part II: Open-Shell First-Row Transition Metal Complexes” Plenary Lecture at the 60th Sanibel Symposium, St. Simons Island, GA, February 16-21, 2020.
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19) Mark A. Iron and Trevor Janes, "Density Functional Theory and Transition Metal Reactions - Navigating the Alphabet Soup of Functionals" at the 59th Sanibel Symposium, St. Simons Island, GA, February 17-22, 2019.
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18) Mark A. Iron, "Estimating Equilibrium Isotopic Fractionation in the Environment Using Density Functional Calculations" at the 58th Sanibel Symposium, St. Simons Island, GA, February 18-23, 2018.
17) Mark A. Iron, "Computational Insights into Sulphur Isotopic Fractionation in Carbonate-Associated Sulphate" at the 11th Triennial Congress of the World Association of Theoretical and Computational Chemistry (WATOC), Munich, Germany, August 27 - September 1, 2017.
16) Mark A. Iron, "Factors Impacting the Accuracy of ¹³C NMR Chemical Shift Predictions Using Density Functional Theory – The Advantage of Long-Range Corrected Functionals" at the 2nd Israeli Conference on Computational Modeling of Molecules and Solids, Tel Aviv University, Tel Aviv, Israel, July 6, 2017.
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15) Mark A. Iron, "Factors Impacting the Accuracy of ¹³C NMR Chemical Shift Predictions Using Density Functional Theory – The Advantage of Long-Range Corrected Functionals" at the 57th Sanibel Symposium, St. Simons Island, GA, February 19-24, 2017.
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14) Mark A. Iron, "Factors Impacting the Accuracy of ¹³C NMR Chemical Shift Predictions Using Density Functional Theory – The Advantage of Long-Range Corrected Functionals" at the Australian Symposium on Computational Chemistry - A Celebration in Honour of Leo Radom and Jan Martin, University of Western Australia, Perth, WA, Australia, December 1-2, 2016. (Invited Lecture)
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13) Mark A. Iron, "On the Innocence of Bipyridine Ligands: How Well Do DFT Functionals Fare for These Challenging Spin Systems" at the 56th Sanibel Symposium, St. Simons Island, GA, February 14-19, 2016.
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12) Mark A. Iron and Petr Milko, "On the Innocence of Bipyridine Ligands: How Well Do DFT Functionals Fare for These Challenging Spin Systems" at the 81st Annual Meeting of the Israel Chemical Society, Tel Aviv, Israel, February 9-10, 2016.
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11) Mark A. Iron, “A DFT Study on Pincer Ligand Scaffold Participation in Organometallic Reactions” at the Theory and Applications of Computational Chemistry (TACC-2012) Conference, Pavia, Italy, September 2–7, 2012.
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10) Mark A. Iron, “A DFT Investigation of the Implausible Probable: A Water-Stable Organic Dianion” at the 74th Meeting of the Israel Chemical Society, Tel Aviv, Israel, February 8–9, 2009.
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9) Mark A. Iron, “A DFT Investigation of the Implausible Probable: A Water-Stable Organic Dianion” at the 8th Triennial Congress of the World Association of Theoretical and Computational Chemists (WATOC), Sydney, Australia, September 14–19, 2008.
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8) Mark A. Iron, Grażyna Staszewska, Nathan E. Schultz, Thomas J. Preston, and Donald G. Truhlar,* “Tight Binding–Configuration Interaction (TBCI): A Novel Non-Iterative Method to Incorporate Charges into Tight Binding” at the 233rd American Chemical Society Meeting, Chicago, IL, March 25–29, 2007.
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7) Mark A. Iron, Grażyna Staszewska, Nathan E. Schultz, Thomas J. Preston, and Donald G. Truhlar,* “Tight Binding–Configuration Interaction (TBCI): A Novel Non-Iterative Method to Incorporating Charges into Tight Binding” at the 72nd Annual Meeting of the Israel Chemical Society, Tel Aviv, Israel, February 6–7, 2007.
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6) Mark A. Iron, “Novel Methods for Modelling Aluminum Nanoparticles” at the 231th American Chemical Society National Meeting, Atlanta, GA, March 26–30, 2006.
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5) Mark A. Iron, Milko E. van der Boom,* and Jan M. L. Martin,* “Everything You Always Wanted to Know about Metallabenzenes but were Afraid to Ask” at the 70th Meeting of the Israel Chemical Society, Tel Aviv, Israel, February 15–16, 2005.
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4) Mark A. Iron, Milko E. van der Boom,* and Jan M. L. Martin,* “A Computational Foray into the Reactivity and Properties of Metallabenzene Complexes” at the 228th American Chemical Society National Meeting, Philadelphia, PA, August 22–26, 2004.
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3) Mark A. Iron, Andreas Sundermann and Jan M. L. Martin,* “Exploring the Mechanism of Catalytic Acetone Hydrogenation Using Denstiy Functional Theory” at the 225th American Chemical Society National Meeting, New Orleans, LA, March 23–27, 2003.
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2) Mark A. Iron, Ehud Keinan,* and Jan M. L. Martin,* “Why Does H/D Scrambling Occur in TpPtMeH2 but Methane Loss is not Observed? A DFT Investigation” at the 225th American Chemical Society National Meeting, New Orleans, LA, March 23–27, 2003.
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1) Mark A. Iron, Milko E. van der Boom* and Jan M. L. Martin,* “Mechanistic Aspects of Addition Ractions to Metalloaromatic Complexes of Iridium: A Computational Investigation" at the 225th American Chemical Society National Meeting, New Orleans, LA, March 23–27, 2003.