From Chaos to Order: Chain-Length Dependence of the Free Energy of Formation of Meso-tetraalkylporphyrin Self-Assembled Monolayer Polymorphs

Jeffrey R Reimers; Dwi Panduwinata; Johan Visser; Yiing Chin; Chunguang Tang; Lars Goerigk; Michael J Ford; Maxine Baker; Tze Jing Sum; Michiel JJ Coenen; Bas LM Hendriksen; Johannes AAW Elemans; Noel S Hush; Maxwell J Crossley

Journal article

From Chaos to Order: Chain-Length Dependence of the Free Energy of Formation of Meso-tetraalkylporphyrin Self-Assembled Monolayer Polymorphs

Jeffrey R Reimers, Dwi Panduwinata, Johan Visser, Yiing Chin, Chunguang Tang, Lars Goerigk, Michael J Ford, Maxine Baker, Tze Jing Sum, Michiel JJ Coenen, Bas LM Hendriksen, Johannes AAW Elemans, Noel S Hush, Maxwell J Crossley

JOURNAL OF PHYSICAL CHEMISTRY C | AMER CHEMICAL SOC | Published : 2016

DOI: 10.1021/acs.jpcc.5b11621

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University of Melbourne Researchers

Lars Goerigk Author Chemistry

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Awarded by Australian Research Council

Awarded by Council for the Chemical Sciences of The Netherlands Organization for Scientific Research (CW-NWO)

Awarded by European Research Council

Awarded by Ministry of Education, Culture and Science

Funding Acknowledgements

We thank the Australian Research Council for funding this research (Grants LP0455238, DP12010259, and DE140100550) and National Computational Infrastructure (NCI) and INTERSECT for provision of computing resources. J.A.A.W.E. thanks the Council for the Chemical Sciences of The Netherlands Organization for Scientific Research (CW-NWO) for a Vidi grant (700.58.423), and the European Research Council for an ERC Starting Grant (NANOCAT-259064), and the Ministry of Education, Culture and Science (Gravity Program 024.001.035).