Publications

 

  1. Barroo, C; Montemore, M; Janvelyan, N; Zugic, B; Akey, A; Magyar, A; Ye, J; Kaxiras, E; Biener, J; Bell, D. Macroscopic 3D Nanoporosity Formation by Dry Oxidation of AgAu Alloys, J. Phys. Chem. C, 2017, 121 (9), pp 5115–5122. http://pubs.acs.org/doi/abs/10.1021/acs.jpcc.6b12847

  2. Friend, C.M and Bingjun, X; Heterogeneous Catalysis - A Central Science for a Sustainable Future, Acc. Chem. Res., 2017, 50 (3), pp 517–521http://pubs.acs.org/doi/abs/10.1021/acs.accounts.6b00510

  3. Personick, M.L; Madix, R.J; Friend, C.M. Selective Oxygen-Assisted Reactions of Alcohols and Amines Catalyzed by Metallic Gold: Paradigms for the Design of Catalytic Processes, ACS Catal., 2017, 7, 965–985, DOI: 10.1021/acscatal.6b02693 http://pubs.acs.org/doi/full/10.1021/acscatal.6b02693
  4. Zugic, B; Wang, L-C; Heine, C;  Zakharov, D. N;  Lechner, B.A.J;  Stach, E.A; Biener, J;  Salmeron, M; Madix, R.J; Friend, C.M., Dynamic Restructuring Drives Catalytic Activity on Nanoporous Gold-Silver Alloy Catalysts, Nat. Mater., 2016, doi:10.1038/nmat4824 http://www.nature.com/nmat/journal/vaop/ncurrent/full/nmat4824.html?WT.f... 
  5. Shan, J; Janvelyan, N; Friend, C; Biener, J; Flytzani-Stephanopoulos M., Selective non-oxidative dehydrogenation of ethanol to acetaldehyde and hydrogen on highly dilute NiCu alloysApplied Catalysis B:  Environmental., 2016, Accepted. http://www.sciencedirect.com/science/article/pii/S0926337316309808
  6. Karakalos, S; Xu, Y-F;   Kabeer, F.C; Chen, W.; Rodriguez-Reyes, J. C; Tkatchenko, A; Kaxiras, E;  Madix, R;  Friend, C.M., Non-Covalent Bonding Controls Selectivity in Heterogeneous Catalysis: Coupling Reactions on Gold,    J. Am. Chem. Soc., 2016, 138 (46), 15243–15250http://pubs.acs.org/doi/abs/10.1021/jacs.6b09450
  7. Heine, C;  Lechner, B.A.J;  Bluhm, H;  Salmeron, M.,  Recycling of CO2: Probing the chemical state of the Ni(111) surface during the methanation reaction with ambient pressure x-ray photoelectron spectroscopy, J. Am. Chem. Soc., 2016, 138 (40), 13246–13252. http://pubs.acs.org/doi/abs/10.1021/jacs.6b06939
  8. Wang, L-C; Personick, M.L; Fushimi, R;  Friend, C.M;  Madix, R.J.,  Active Sites for Methanol Partial Oxidation on Nanoporous Gold Catalysts, J. Catal., 2016, 344, 778–783.http://dx.doi.org/10.1016/j.jcat.2016.08.012
  9. Zhou, Y; Chen, W; Cui, P; Zeng, J; Lin, Z; Kaxiras, E;  Zhang, Z., Enhancing the hydrogen activation reactivity of non-precious metal substrates via confined catalysis underneath graphene, Nano Lett., 2016, 16 (10), 6058–6063http://pubs.acs.org/doi/abs/10.1021/acs.nanolett.6b02052
  10. Montemore, M;   Cubuk, E.D;    Klobas, J.E;   Schmid, M;    Madix, R.J;   Friend, C.M;   Kaxiras, E; Controlling O coverage and stability by alloying Au and AgPhys. Chem. Chem. Phys., 2016,18, 26844-26853.  DOI: 10.1039/C6CP05611C

  11. Barroo, C; Janvelyan, N; Zugic, B; Magyar, A.P;  Akey, A.J; Biener, J;  Friend, C.M;  Bell, D.C., Surface Modifications during a Catalytic Reaction: a Combined APT and FIB/SEM Analysis of Surface SegregationMicrosc. Microanal. 2016, 22 (Suppl 3), 356-357. https://doi.org/10.1017/S1431927616002634

  12. Wang, Z-T; Matthew, T;  Andrew, J D; El-Soda, M;  Michaelides, A; Stamatakis, M;  Sykes, ECH., Preparation, Structure, and Surface Chemistry of Ni-Au Single Atom AlloysJ. Phys. Chem. C, 2016, 120 (25), pp 13574–13580. http://pubs.acs.org/doi/abs/10.1021/acs.jpcc.6b03473

  13. Karakalos, S; Stowers, K. J; Zugic, B; Biener, M; Biener, J; Madix, R. J;  Friend, C. M., Catalytic production of methyl acrylates by gold-mediated cross coupling of unsaturated aldehydes with methanol, Surf. Sci., 2016, 652, 58-66. http://dx.doi.org/10.1016/j.susc.2016.03.017

  14. Hiebel, F;  Shong, B;  Chen, W;  Kaxiras, E;  Friend, C.M.,  Self-Assembly of Acetate Adsorbates Drive Atomic Rearrangement on the Au(110) Surface,  Nature Comm., 2016, 7, 13139. http://www.nature.com/articles/ncomms13139

  15. Zugic, B; Karakalos, S; Stowers, K.J; Biener, M.M; Biener, J.J; Friend, C.M;  Madix, R.J., Continuous Catalytic Production of Methyl Acrylates from Unsaturated Alcohols by Nanoporous Gold: The Strong Effect of C=C Unsaturation on Reaction Selectivity, ACS Catalysis, 2016, 6(3), 1833-1839.  http://pubs.acs.org/doi/abs/10.1021/acscatal.5b02902

  16. Heine, C; Baran, E; Lechner, B. A. G;  Salmeron, M.,  A Study of the O/Ag (111) system with scanning tunneling microscopy and x-ray photoelectron spectroscopy at ambient pressures, Surf. Sci., 2016, 652, 51-57. http://dx.doi.org/10.1016/j.susc.2016.02.012

  17. Falcucci, G; Montessori, A; Succi, S; Prestininzi, P; Zugic, B; Barroo, C; Biener, M.M; Biener, J; Bell, D.C;  Kaxiras, E., Mapping reactive flow patterns in monolithic nanoporous catalystsMicrofluid Nanofluid, 2016, 20(7),1-13.  https://arxiv.org/abs/1607.02874

  18. Montemore, M.M; Madix, R. J;  Kaxiras, E., How Does Nanoporous Gold Dissociate Molecular Oxygen? J. Phys. Chem. C, 2016, 120 (30), 16636–16640. http://pubs.acs.org/doi/abs/10.1021/acs.jpcc.6b03371

  19. Wang, L-C;  Friend, C.M;   Madix, R.J; Active site densities, oxygen activation and adsorbed reactive oxygen in alcohol activation on npAu catalysts, Faraday Discuss., 2016,188, 57-67.http://pubs.rsc.org/en/Content/ArticleLanding/2016/FD/c5fd00161g#!divAbstract

  20. Shan, J; Lucci, FR; Liu, J; Soda M; Marcinkowski MD; Allard LF; Sykes ECH; Flytzani-Stephanopoulos M., Water co-catalyzed selective dehydrogenation of methanol to formaldehyde and hydrogen, Surf. Sci., 2016, 650, 121-129. 
    http://dx.doi.org/10.1016/j.susc.2016.02.010

  21. Nguyen, L;  Tao, F.,   Development of a reaction cell for in-situ/operando studies of surface of a catalyst under a reaction condition and during catalysisRev. Sci. Instrum. 2016, 87, 064101. http://dx.doi.org/10.1063/1.4946877

  22. Di Staso, G; Clercx, H.J.H; Succi, S; Toschi, F., DSMC-LBM mapping scheme for rarefied and non-rarefied gas flows, J. Comp. Sci., Accepted, https://arxiv.org/abs/1512.08042

  23. Montessori, A; Prestininzi, P; La Rocca, M; Falcucci, G; Succi, S; Kaxiras, E., Effects of Knudsen diffusivity on the effective reactivity of nanoporous catalyst media,  J. Comp. Sci., 2016.http://dx.doi.org/10.1016/j.jocs.2016.04.006

  24. Tao, F; Crozier, P., Atomic-Scale Observations of Catalyst Structures under Reaction Conditions and during Catalysis for Fundamental Understanding of Catalysis, Chem. Rev., 2016, 116, 3487−3539. http://pubs.acs.org/doi/abs/10.1021/cr5002657 

  25. Montessori, A;  Prestininzi, P;  La Rocca, M;   Succi, S., Lattice Boltzmann approach for complex non equilibrium flowsPhy. Rev. E, 2015,  92, 043308. http://journals.aps.org/pre/abstract/10.1103/PhysRevE.92.043308

  26. Hiebel,  F; Montemore, M; Kaxiras, E; Friend, C.M; Direct visualization of quasi-ordered oxygen chain structures on Au(110)-(1 × 2) Surf. Sci., Accepted.http://dx.doi.org/10.1016/j.susc.2015.09.018

  27. Biener, J; Biener, M; Madix, R.J; Friend, C.M., Nanoporous Gold: Understanding the Origin of the Reactivity of a 21st Century Catalyst Made by Pre-Columbian Technology ACS Catal., 2015, 5, 6263–6270. http://pubs.acs.org/doi/abs/10.1021/acscatal.5b01586

  28. Personick, M.L; Zugic, B; Biener, M.M; Biener, J; Madix, R.J; Friend, C.M; Ozone-Activated Nanoporous Gold: A Stable and Storable Material for Catalytic Oxidation ACS Catal., 2015, 5 (7), pp 4237–4241. http://pubs.acs.org/doi/abs/10.1021/acscatal.5b00330

  29. Wang, L-C; Stowers, K.J; Zugic, B; Personic, M.L; Biener, M; Biener, J; Friend, C.M; Madix, R.J., Exploiting basic principles to control the selectivity of the vapor phase catalytic oxidative cross-coupling of primary alcohols over nanoporous gold catalysts, J. Catal., 2015, 329, 78-86. http://dx.doi.org/10.1016/j.jcat.2015.04.022

  30. Personick, ML; Montemore, M; Madix, RJ; Kaxiras, E; Biener, J; Friend, CM., Catalyst design for enhanced sustainability through fundamental surface chemistry Phil. Trans. R. Soc. A., 2015, 374: 20150077 http://rsta.royalsocietypublishing.org/content/374/2061/20150077

  31. Barroo, C; Magyar, A; Bell, D., Catalysis and Atom Probe Tomography: Recent Progresses and Future Developments towards the Analysis of Nanoporous Samples microsc.microanal, 2015, 21, 855-856. http://journals.cambridge.org/fulltext_content/supplementary/MAM_V21_min...