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Rees B. Rankin, Ph.D. - Publications

Affiliations: 
2001-2006 Chemical Engineering Carnegie Mellon University, Pittsburgh, PA 
 2013-2018 Chemical Engineering Villanova University, Villanova, PA, USA 
Area:
Transport Through Nanoporous Materials, Chiral Surface Chemistry
Website:
reesbrankin.com
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38 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2020 Ananthaneni S, Rankin RB. Computational screening of transition metal/p-block hybrid electrocatalysts for CO reduction. Journal of Computational Chemistry. PMID 32100900 DOI: 10.1002/Jcc.26182  0.761
2020 Waldt CT, Ananthaneni S, Rankin RB. Towards quaternary alloy Au–Pd catalysts for direct synthesis of hydrogen peroxide Materials Today Energy. 16: 100399. DOI: 10.1016/J.Mtener.2020.100399  0.762
2019 Lozano T, Rankin RB. Size, Composition, and Support-Doping Effects on Oxygen Reduction Activity of Platinum-Alloy and on Non-platinum Metal-Decorated-Graphene Nanocatalysts. Frontiers in Chemistry. 7: 610. PMID 31608270 DOI: 10.3389/Fchem.2019.00610  0.715
2019 Rankin RB. Similarities and differences for atomic and diatomic molecule adsorption on the B-5 type sites of the HCP(101̅6) surfaces of Co, Os, and Ru from DFT calculations. Heliyon. 5: e01924. PMID 31508514 DOI: 10.1016/J.Heliyon.2019.E01924  0.417
2019 Rankin R, Lozano T. Adsorption Energy Shifts for Oxygen and Hydroxyl on 4-atom Metal-Decorated Graphene Catalysts Via Solvation, pH, and Substrate Dopants: Effects on ORR Activity Metals. 9: 227. DOI: 10.3390/met9020227  0.709
2019 Ananthaneni S, Smith Z, Rankin RB. Graphene Supported Tungsten Carbide as Catalyst for Electrochemical Reduction of CO2 Catalysts. 9: 604. DOI: 10.3390/Catal9070604  0.753
2019 Rankin RB, Waldt CT. Computational Screening for Developing Optimal Intermetallic Transition Metal Pt-Based ORR Catalysts at the Predictive Volcano Peak The Journal of Physical Chemistry C. 123: 13236-13245. DOI: 10.1021/Acs.Jpcc.8B11494  0.494
2019 Ananthaneni S, Rankin RB. Effects of surface structure and halogen substitution on electronic charge transfer in adlayers of (BETS)2-GaCl4 on silver surfaces Surface Science. 687: 34-40. DOI: 10.1016/J.Susc.2019.01.004  0.714
2018 Lozano T, Rankin RB. Computational predictive design for metal-decorated-graphene size-specific subnanometer to nanometer ORR catalysts Catalysis Today. 312: 105-117. DOI: 10.1016/J.Cattod.2018.04.013  0.729
2015 Clayborne A, Chun HJ, Rankin RB, Greeley J. Elucidation of Pathways for NO Electroreduction on Pt(111) from First Principles. Angewandte Chemie (International Ed. in English). 54: 8255-8. PMID 26053610 DOI: 10.1002/Anie.201502104  0.754
2015 Clayborne A, Chun H, Rankin RB, Greeley J. Inside Back Cover: Elucidation of Pathways for NO Electroreduction on Pt(111) from First Principles (Angew. Chem. Int. Ed. 28/2015) Angewandte Chemie International Edition. 54: 8299-8299. DOI: 10.1002/Anie.201504836  0.758
2015 Clayborne A, Chun H, Rankin RB, Greeley J. Innenrücktitelbild: Elucidation of Pathways for NO Electroreduction on Pt(111) from First Principles (Angew. Chem. 28/2015) Angewandte Chemie. 127: 8417-8417. DOI: 10.1002/Ange.201504836  0.758
2014 Chun HJ, Clayborne PA, Rankin RB, Greeley JP. NO electrochemical reduction on Pt electrocatalyst: A DFT approach Catalysis and Reaction Engineering Division 2014 - Core Programming Area At the 2014 Aiche Annual Meeting. 2: 613.  0.521
2013 Smerdon JA, Rankin RB, Greeley JP, Guisinger NP, Guest JR. Chiral "pinwheel" heterojunctions self-assembled from C60 and pentacene. Acs Nano. 7: 3086-94. PMID 23488794 DOI: 10.1021/Nn304992C  0.505
2013 Yitamben EN, Niebergall L, Rankin RB, Iski EV, Rosenberg RA, Greeley JP, Stepanyuk VS, Guisinger NP. Tracking amino acids in chiral quantum corrals Journal of Physical Chemistry C. 117: 11757-11763. DOI: 10.1021/Jp400074R  0.505
2012 Wang C, Li D, Chi M, Pearson J, Rankin RB, Greeley J, Duan Z, Wang G, van der Vliet D, More KL, Markovic NM, Stamenkovic VR. Rational Development of Ternary Alloy Electrocatalysts. The Journal of Physical Chemistry Letters. 3: 1668-73. PMID 26285726 DOI: 10.1021/Jz300563Z  0.593
2012 Mehmood F, Rankin RB, Greeley J, Curtiss LA. Trends in methanol decomposition on transition metal alloy clusters from scaling and Brønsted-Evans-Polanyi relationships. Physical Chemistry Chemical Physics : Pccp. 14: 8644-52. PMID 22588638 DOI: 10.1039/C2Cp00052K  0.539
2012 van der Vliet DF, Wang C, Li D, Paulikas AP, Greeley J, Rankin RB, Strmcnik D, Tripkovic D, Markovic NM, Stamenkovic VR. Unique electrochemical adsorption properties of Pt-skin surfaces. Angewandte Chemie (International Ed. in English). 51: 3139-42. PMID 22351117 DOI: 10.1002/Anie.201107668  0.558
2012 Wang C, Li D, Chi M, Pearson J, Rankin RB, Greeley J, Duan Z, Wang G, Van Der Vliet D, More KL, Markovic NM, Stamenkovic VR. Rational development of ternary alloy electrocatalysts Journal of Physical Chemistry Letters. 3: 1668-1673. DOI: 10.1021/jz300563z  0.429
2012 Rankin RB, Greeley J. Trends in selective hydrogen peroxide production on transition metal surfaces from first principles Acs Catalysis. 2: 2664-2672. DOI: 10.1021/Cs3003337  0.629
2012 Ferguson GA, Mehmood F, Rankin RB, Greeley JP, Vajda S, Curtiss LA. Exploring computational design of size-specific subnanometer clusters catalysts Topics in Catalysis. 55: 353-365. DOI: 10.1007/S11244-012-9804-4  0.595
2012 Rankin RB, Greeley J. Development of volcano plots for selected reactions in heterogeneous catalysis and electrocatalysis Aiche 2012 - 2012 Aiche Annual Meeting, Conference Proceedings.  0.45
2011 Hao S, Rankin RB, Johnson JK, Sholl DS. Surface reactions of AsH3, H2Se, and H2S on the Zn2TiO4(010) surface Surface Science. 605: 818-823. DOI: 10.1016/J.Susc.2011.01.025  0.578
2009 Liu J, Rankin RB, Johnson JK. The importance of charge-quadrupole interactions for H2 adsorption and diffusion in CuBTC Molecular Simulation. 35: 60-69. DOI: 10.1080/08927020802398926  0.406
2009 Rankin RB, Liu J, Kulkarni AD, Johnson JK. Adsorption and diffusion of light gases in ZIF-68 and ZIF-70: A simulation study Journal of Physical Chemistry C. 113: 16906-16914. DOI: 10.1021/Jp903735M  0.4
2009 Keskin S, Liu J, Rankin RB, Johnson JK, Sholl DS. Progress, opportunities, and challenges for applying atomically detailed modeling to molecular adsorption and transport in metal - Organic framework materials Industrial and Engineering Chemistry Research. 48: 2355-2371. DOI: 10.1021/Ie800666S  0.65
2008 Rankin RB, Campos A, Tian H, Siriwardane R, Roy A, Spivey JJ, Sholl DS, Johnson JK. Characterization of bulk structure in zinc orthotitanate: A density functional theory and EXAFS investigation Journal of the American Ceramic Society. 91: 584-590. DOI: 10.1111/J.1551-2916.2007.02186.X  0.555
2008 Rankin RB, Sholl DS, Johnson JK. Density functional theory calculations of the surface structure of the inverse spinel zinc orthotitanate Journal of Physics Condensed Matter. 20. DOI: 10.1088/0953-8984/20/9/095001  0.556
2008 Dai B, Rankin RB, Johnson JK, Allendorf MD, Sholl DS, Zarkevich NA, Johnson DD. Influence of surface reactions on complex hydride reversibility Journal of Physical Chemistry C. 112: 18270-18279. DOI: 10.1021/Jp807162K  0.579
2008 Rankin RB, Hao S, Sholl DS, Johnson JK. DFT characterization of adsorption and diffusion mechanisms of H, As, S, and Se on the zinc orthotitanate(0 1 0) surface Surface Science. 602: 1877-1882. DOI: 10.1016/J.Susc.2008.03.037  0.589
2007 Rankin RB, Johnson K, Sholl DS, Hao S. Density functional theory characterization of zinc orthotitanate sorbents for hydrogen sulfide dissociation Aiche Annual Meeting, Conference Proceedings.  0.439
2007 Rankin RB, Johnson K, Sholl DS, Hao S. Density functional theory characterization of zinc orthotitanate sorbents for hydrogen sulfide dissociation Aiche Annual Meeting, Conference Proceedings.  0.439
2007 Rankin RB, Johnson JK, Sholl DS, Tian H, Siriwardane R, Campos A, Spivey JJ, Roy AD. Computational design of novel sorbent materials for IGCC H2S removal and process intensification Acs National Meeting Book of Abstracts.  0.374
2006 Rankin RB, Sholl DS. Structures of dense glycine and alanine adlayers on chiral Cu(3,1,17) surfaces. Langmuir : the Acs Journal of Surfaces and Colloids. 22: 8096-103. PMID 16952247 DOI: 10.1021/La0613272  0.52
2006 Rankin RB, Sholl DS. First-principles studies of chiral step reconstructions of Cu(100) by adsorbed glycine and alanine. The Journal of Chemical Physics. 124: 74703. PMID 16497066 DOI: 10.1063/1.2168440  0.496
2005 Rankin RB, Sholl DS. Structures of glycine, enantiopure alanine, and racemic alanine adlayers on Cu(110) and Cu(100) surfaces. The Journal of Physical Chemistry. B. 109: 16764-73. PMID 16853135 DOI: 10.1021/Jp0535700  0.51
2005 Rankin RB, Sholl DS. Structure of enantiopure and racemic alanine adlayers on Cu(1 1 0) Surface Science. 574: L1-L8. DOI: 10.1016/J.Susc.2004.10.025  0.502
2004 Rankin RB, Sholl DS. Assessment of heterochiral and homochiral glycine adlayers on Cu(1 1 0) using density functional theory Surface Science. 548: 301-308. DOI: 10.1016/J.Susc.2003.11.021  0.497
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