2017

Publications

2017

  • G. H. Gu, B. Schweitzer, C. Michel, S. N. Steinmann, P. Sautet, and D. G. Vlachos, Group Additivity for Aqueous Phase Thermochemical Properties of Alcohols on Pt(111). J. Phys. Chem. C 121(39), 21510-21519 (2017).
  • H. Nguyen, R. F. DeJaco, N. Mittal, J. I. Siepmann, M. Tsapatsis, M. A. Snyder, W. Fan, B. Saha, and D. G. Vlachos, A Review of Biorefinery Separations for Bioproduct Production via Thermocatalytic Processing, in Annual Review of Chemical and Biomolecular Engineering 8, 115-137 (2017).
  • M. Nunez, T. Robie, and D. G. Vlachos, Acceleration and sensitivity analysis of lattice kinetic Monte Carlo simulations using parallel processing and rate constant rescaling. J. Chem. Phys. 147(16), 10 (2017).
  • J. Y. Fu, E. S. Vasiliadou, K. A. Goulas, B. Saha, and D. G. Vlachos, Selective hydrodeoxygenation of tartaric acid to succinic acid. Catal. Sci. Technol. 7(21), 4944-4954 (2017).
  • M. J. Gilkey, A. V. Mironenko, D. G. Vlachos, and B. J. Xu, Adipic Acid Production via Metal-Free Selective Hydrogenolysis of Biomass-Derived Tetrahydrofuran-2,5-Dicarboxylic Acid. ACS Catal. 7(10), 6619-6634 (2017).
  • J. L. Lansford, A. V. Mironenko, and D. G. Vlachos, Scaling relationships and theory for vibrational frequencies of adsorbates on transition metal surfaces. Nature Communications 8, No. 1842 (2017).
  • J. Fu, E. S. Vasiliadou, K. A. Goulas, B. Saha, and D. G. Vlachos, Selective Hydrodeoxygenation of Tartaric Acid to Succinic Acid. Catal. Sci. Technol. 7, 4893-4904 (2017).
  • S. Dutta, A. Bohre, W. Q. Zheng, G. R. Jenness, M. Nunez, B. Saha, and D. G. Vlachos, Solventless C-C Coupling of Low Carbon Furanics to High Carbon Fuel Precursors Using an Improved Graphene Oxide Carbocatalyst. ACS Catal. 7(6), 3905-3915 (2017).
  • R. E. Patet, W. Fan, D. G. Vlachos, and S. Caratzoulas, Tandem Diels-Alder Reaction of Dimethylfuran and Ethylene and Dehydration to para-Xylene Catalyzed by Zeotypic Lewis Acids. ChemCatChem 9(13), 2523-2535 (2017).
  • R. E. Patet, M. Koehle, R. F. Lobo, S. Caratzoulas, and D. G. Vlachos, General Acid-Type Catalysis in the Dehydrative Aromatization of Furans to Aromatics in H-[AI] -BEA, H-[Fe]-BEA, H-[Ga]-BEA, and H-[B]-BEA Zeolites. J. Phys. Chem. C 121(25), 13666-13679 (2017).
  • M. J. Gilkey, D. G. Vlachos, and B. J. Xu, Poisoning of Ru/C by homogeneous Bronsted acids in hydrodeoxygenation of 2,5-dimethylfuran via catalytic transfer hydrogenation. Appl. Catal. A-Gen. 542, 327-335 (2017).
  • W. M. Wan, G. R. Jenness, K. Xiong, D. G. Vlachos, and J. G. G. Chen, Ring-Opening Reaction of Furfural and Tetrahydrofurfuryl Alcohol on Hydrogen-Predosed Iridium(111) and Cobalt/Iridium(111) Surfaces. ChemCatChem 9(9), 1701-1707 (2017).
  • E. Miliordos, S. Caratzoulas, and D. G. Vlachos, A periodic-DF’T study of retro-aldol fragmentation of fuctose on MoO3. Appl. Catal. A-Gen. 530, 75-82 (2017).
  • T. R. Josephson, S. K. Brand, S. Caratzoulas, and D. G. Vlachos, 1,2-H- versus 1,2-C-Shift on Sn-Silsesquioxanes. ACS Catal. 7(1), 25-33 (2017).