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.
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.
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.
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.
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)
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.
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.
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.
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.
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.
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.
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.
6) Mark A. Iron, “Novel Methods for Modelling Aluminum Nanoparticles” at the 231th American Chemical Society National Meeting, Atlanta, GA, March 26–30, 2006.
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.
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.
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.
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.
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.