Publications

Peer-reviewed publications of research supported in part or in whole under an EFRC are listed below. Publications are ordered first by year, then alphabetically by EFRC acronym, and finally alphabetically by first author. Links to the DOI and associated EFRC appear at the end of each citation. The publication list is updated periodically; the last such update was May 21, 2014.

901.Kraabel, B.; Lee, C. H.; McBranch, D.; Moses, D.; Sariciftci, N. S.; and Heeger, A. J.  Historical perspective on: Ultrafast photoinduced electron transfer in conducting polymer-buckminsterfullerene composites [Volume 213, Issues 3-4, 8 October 1993, Pages 389-394]  Chemical Physics Letters, 589, 61-62 (2013).  [DOI: 10.1016/j.cplett.2013.08.049External link] [CEEM]
902.Lee, J. E.; Mubeen, S.; Hernandez-Sosa, G.; Sun, Y. M.; Toma, F. M.; Stucky, G. D.; and Moskovits, M.  High-Efficiency Panchromatic Hybrid Schottky Solar Cells  Advanced Materials, 25, 256-260 (2013).  [DOI: 10.1002/Adma.201202451External link] [CEEM]
903.Leong, W. L.; Welch, G. C.; Seifter, J.; Seo, J. H.; Bazan, G. C.; and Heeger, A. J.  Understanding the Role of Thermal Processing in High Performance Solution Processed Small Molecule Bulk Heterojunction Solar Cells  Advanced Energy Materials, 3, 356-363 (2013).  [DOI: 10.1002/Aenm.201200631External link] [CEEM]
904.Love, John A.; Proctor, Christopher M.; Liu, Jianhua; Takacs, Christopher J.; Sharenko, Alexander; van der Poll, Thomas S.; Heeger, Alan J.; Bazan, Guillermo C.; and Nguyen, Thuc-Quyen  Film Morphology of High Efficiency Solution-Processed Small-Molecule Solar Cells  Advanced Functional Materials, 23, 5019-5026 (2013).  [DOI: 10.1002/adfm.201300099External link] [CEEM]
905.Lu, Hong; Ouellette, Daniel G.; Preu, Sascha; Watts, Justin D.; Zaks, Benjamin; Burke, Peter G.; Sherwin, Mark S.; and Gossard, Arthur C.  Self-Assembled ErSb Nanostructures with Optical Applications in Infrared and Terahertz  Nano Letters, , (2013).  [DOI: 10.1021/nl402436gExternal link] [CEEM]
906.MacKenzie, R. C. I.; Shuttle, C. G.; Dibb, G. F.; Treat, N.; von Hauff, E.; Robb, M. J.; Hawker, C. J.; Chabinyc, M. L.; and Nelson, J.  Interpreting the Density of States Extracted from Organic Solar Cells Using Transient Photocurrent Measurements  Journal of Physical Chemistry C, 117, 12407-12414 (2013).  [DOI: 10.1021/Jp4010828External link] [CEEM]
907.Marquardt, O.; Hickel, T.; Neugebauer, J.; and Van de Walle, C. G.  Polarization effects due to thickness fluctuations in nonpolar InGaN/GaN quantum wells  Applied Physics Letters, 103, (2013).  [DOI: 10.1063/1.4818752External link] [CEEM]
908.Martinelli, Lucio; Peretti, Jacques; Speck, James S.; Weisbuch, Claude; and Iveland, Justin  Direct Measurement of Auger Electrons Emitted from a Semiconductor Light-Emitting Diode under Electrical Injection: Identification of the Dominant Mechanism for Efficiency Droop  Physical Review Letters, 110, 177406 (2013).  [DOI:External link] [CEEM]
909.McMahon, W. E.; Lin, C. T.; Ward, J. S.; Geisz, J. F.; Wanlass, M. W.; Carapella, J. J.; Olavarria, W.; Young, M.; Steiner, M. A.; France, R. M.; Kibbler, A. E.; Duda, A.; Olson, J. M.; Perl, E. E.; Friedman, D. J.; and Bowers, J. E.  Metal Pillar Interconnection Topology for Bonded Two-Terminal Multijunction III-V Solar Cells  Ieee Journal of Photovoltaics, 3, 868-872 (2013).  [DOI: 10.1109/Jphotov.2012.2234208External link] [CEEM]
910.Miao, M. S.; Yan, Q. M.; and Van de Walle, C. G.  Electronic structure of a single-layer InN quantum well in a GaN matrix  Applied Physics Letters, 102, 102103-3 (2013).  [DOI:External link] [CEEM]
911.Mubeen, Syed ; Lee, Joun; Singh, Nirala; Kramer, Stephan; Stucky, Galen D.; and Moskovits, Martin  An autonomous photosynthetic device in which all charge carriers derive from surface plasmons  Nat. Nanotechnol., 8, 247-251 (2013).  [DOI: 10.1038/nnano.2013.18External link] [CEEM]
912.Ouellette, D. G.; Moetakef, P.; Cain, T. A.; Zhang, J. Y.; Stemmer, S.; Emin, D.; and Allen, S. J.  High-density Two-Dimensional Small Polaron Gas in a Delta-Doped Mott Insulator  Sci Rep, 3, 3284 (2013).  [DOI: 10.1038/srep03284External link] [CEEM]
913.Ould-Ely, Teyeb; Kaplan-Reinig, Lyle; Morse, Daniel E.; and ,  High-Rate Continuous Synthesis of Nanocrystalline Perovskites and Metal Oxides in a Colliding Vapor Stream of Microdroplets  Adv. Funct. Mater., 104, (2013).  [DOI: 10.1002/adfm.201301916External link] [CEEM]
914.Perez, L. A.; Chou, K. W.; Love, J. A.; van der Poll, T. S.; Smilgies, D. M.; Nguyen, T. Q.; Kramer, E. J.; Amassian, A.; and Bazan, G. C.  Solvent Additive Effects on Small Molecule Crystallization in Bulk Heterojunction Solar Cells Probed During Spin Casting  Adv Mater, , (2013).  [DOI: 10.1002/adma.201302389External link] [CEEM]
915.Pho, T. V.; Toma, F. M.; Chabinyc, M. L.; and Wudl, F.  Self-Assembling Decacyclene Triimides Prepared through a Regioselective Hextuple Friedel-Crafts Carbamylation  Angewandte Chemie-International Edition, 52, 1446-1451 (2013).  [DOI: 10.1002/Anie.201207608External link] [CEEM]
916.Pho, Toan V.; Toma, Francesca M.; Tremolet de Villers, Bertrand J.; Wang, Sarah; Treat, Neil D.; Eisenmenger, Nancy D.; Su, Gregory M.; Coffin, Robert C.; Douglas, Jessica D.; Fréchet, Jean M. J.; Bazan, Guillermo C.; Wudl, Fred; and Chabinyc, Michael L.  Decacyclene Triimides: Paving the Road to Universal Non-Fullerene Acceptors for Organic Photovoltaics  Advanced Energy Materials, , n/a-n/a (2013).  [DOI: 10.1002/aenm.201301007External link] [CEEM]
917.Preissler, N.; Bierwagen, O.; Ramu, A. T.; and Speck, J. S.  Electrical transport, electrothermal transport, and effective electron mass in single-crystalline In2O3 films  Physical Review B, 88, (2013).  [DOI: 10.1103/PhysRevB.88.085305External link] [CEEM]
918.Ratcliff, Erin L.; Bakus Ii, Ronald C.; Welch, Gregory C.; van der Poll, Tom S.; Garcia, Andres; Cowan, Sarah R.; MacLeod, Bradley A.; Ginley, David S.; Bazan, Guillermo C.; and Olson, Dana C.  Formation of interfacial traps upon surface protonation in small molecule solution processed bulk heterojunctions probed by photoelectron spectroscopy  Journal of Materials Chemistry C, 1, 6223-6234 (2013).  [DOI: 10.1039/C3TC31064GExternal link] [CEEM]
919.Schleife, Andre; Rinke, Patrick; Bechstedt, Friedhelm; and Van de Walle, Chris G.  Enhanced Optical Absorption Due to Symmetry Breaking in TiO2(1-x)S2x Alloys  The Journal of Physical Chemistry C, 117, 4189-4193 (2013).  [DOI: 10.1021/jp3106937External link] [CEEM]
920.Shivaraman, R.; Kawaguchi, Y.; Tanaka, S.; DenBaars, S. P.; Nakamura, S.; and Speck, J. S.  Comparative analysis of 20(2)over-bar1 and 20(2)over-bar(1)over-bar semipolar GaN light emitting diodes using atom probe tomography  Applied Physics Letters, 102, (2013).  [DOI:External link] [CEEM]
921.Snedaker, Matthew L.; Zhang, Yichi; Birkel, Christina S.; Wang, Heng; Day, Tristan; Shi, Yifeng; Ji, Xiulei; Kraemer, Stephan; Mills, Carolyn E.; Moosazadeh, Armin; Moskovits, Martin; Snyder, G. Jeffrey; and Stucky, Galen D.  Silicon-Based Thermoelectrics Made from a Boron-Doped Silicon Dioxide Nanocomposite  Chemistry of Materials, , (2013).  [DOI: 10.1021/cm401990cExternal link] [CEEM]
922.Sztein, A.; Haberstroh, J.; Bowers, J. E.; DenBaars, S. P.; and Nakamura, S.  Calculated thermoelectric properties of InxGa1-xN, InxAl1-xN, and AlxGa1-xN  Journal of Applied Physics, 113, (2013).  [DOI: 10.1063/1.4804174External link] [CEEM]
923.Treat, N. D.; Malik, J. A. N.; Reid, O.; Yu, L. Y.; Shuttle, C. G.; Rumbles, G.; Hawker, C. J.; Chabinyc, M. L.; Smith, P.; and Stingelin, N.  Microstructure formation in molecular and polymer semiconductors assisted by nucleation agents  Nature Materials, 12, 628-633 (2013).  [DOI: 10.1038/Nmat3655External link] [CEEM]
924.Vermeersch, B.; Pernot, G.; Lu, H.; Bahk, J. H.; Gossard, A.; and Shakouri, A.  Picosecond Joule heating in photoconductive switch electrodes  Physical Review B, 88, (2013).  [DOI: 10.1103/Physrevb.88.214302External link] [CEEM]
925.Vermeersch, B.; Bahk, J. H.; Christofferson, J.; and Shakouri, A.  Thermoreflectance imaging of sub 100 ns pulsed cooling in high-speed thermoelectric microcoolers  Journal of Applied Physics, 113, (2013).  [DOI: 10.1063/1.4794166External link] [CEEM]
926.Welch, G. C.; Bakus, R. C.; Teat, S. J.; and Bazan, G. C.  Impact of Regiochemistry and Isoelectronic Bridgehead Substitution on the Molecular Shape and Bulk Organization of Narrow Bandgap Chromophores  Journal of the American Chemical Society, 135, 2298-2305 (2013).  [DOI: 10.1021/Ja310694tExternal link] [CEEM]
927.Yazawa, Kazuaki; and Shakouri, Ali  Cost–Performance Analysis and Optimization of Fuel-Burning Thermoelectric Power Generators  Journal of Electronic Materials, , 1-5 (2013).  [DOI: 10.1007/s11664-013-2480-8External link] [CEEM]
928.Yuen, J. D.; Kumar, R.; Seifter, J.; Valouch, S.; Zakhidov, D.; Moses, D.; Lemmer, U.; Heeger, A. J.; and Wudl, F.  Observations of PDDTT Subject to Thermal Treatment: Correlation between Performance and Order  Journal of the American Chemical Society, 133, 19602-19605 (2013).  [DOI: 10.1021/Ja207312fExternal link] [CEEM]
929.Zhang, Yichi; and Stucky, Galen D.  Heterostructured Approaches to Efficient Thermoelectric Materials  Chemistry of Materials, , (2013).  [DOI: 10.1021/cm402150jExternal link] [CEEM]
930.Zhugayevych, A.; Postupna, O.; Bakus, R. C.; Welch, G. C.; Bazan, G. C.; and Tretiak, S.  Ab Initio Study of a Molecular Crystal for Photovoltaics: Light Absorption, Exciton and Charge Carrier Transport  Journal of Physical Chemistry C, 117, 4920-4930 (2013).  [DOI: 10.1021/Jp310855pExternal link] [CEEM]
931.Abouimrane, Ali; Odom, Susan A.; Tavassol, Hadi; Schulmerich, Matthew V; Wu, H.; Bhargava, Rohit; Gewirth, Andrew A.; Moore, Jeffrey S.; and Amine, Khalil  3-Hexylthiophene as a Stabilizing Additive for High Voltage Cathodes in Lithium-Ion Batteries  J. Electrochem. Soc., 160, A268-A271 (2013).  [DOI: 10.1149/2.039302jesExternal link] [CEES]
932.Assary, Rajeev S.; Lu, Jun; Du, Peng; Luo, Xiangyi; Zhang, Xiaoyi; Ren, Yang ; Curtiss, Larry A; and Amine, Khalil  The Effect of Oxygen Crossover on the Anode of a Li–O2 Battery using an Ether-Based Solvent: Insights from Experimental and Computational Studies  ChemSusChem, 6, 51-55 (2013).  [DOI: 10.1002/cssc.201200810External link] [CEES]
933.Barile, Christopher J.; and Gewirth, Andrew A.  Investigating the Li-O2 Battery in an Ether-Based Electrolyte Using Differential Electrochemical Mass Spectrometry Batteries and Energy Storage  J. Electrochem. Soc, 160, A549-552 (2013).  [DOI: 10.1149/2.033304jesExternal link] [CEES]
934.Bhattacharya, Jishnu ; and Wolverton, Christopher  Relative stability of normal vs. inverse spinel for 3d transition metal oxides as lithium intercalation cathodes  Phys. Chem. Chem. Phys., 17, 6486-6498 (2013).  [DOI: 10.1039/C3CP50910AExternal link] [CEES]
935.Bloom, Ira; Trahey, Lynn; Abouimrane, Ali; Belharouak, Ilias; Zhang, Xiaofeng; Wu, Qingliu; Lu, Wenquan; Abraham, Daniel P.; Bettge, Martin; Elam, Jeffrey W.; Meng, Xiangbo; Burrell, Anthony K.; Ban, Chunmei; Tenent, Robert; Nanda, Jagjit; and Dudney, Nancy  Effect of interface modifications on voltage fade in 0.5Li2MnO3·0.5LiNi0.375Mn0.375Co0.25O2 cathode materials  J. Power Sources, , (2013).  [DOI: 10.1016/j.jpowsour.2013.10.035External link] [CEES]
936.Comstock, David J.; and Elam, Jeffrey W.  Mechanistic Study of Lithium Aluminum Oxide Atomic Layer Deposition  J. Phys. Chem. C, 117, 1677-1683 (2013).  [DOI: 10.1021/jp308828pExternal link] [CEES]
937.de Ruiter, Graham; Lahav, Michal; Evmenenko, Guennadi; Dutta, Pulak; Cristaldi, Domenico A.; Gulino, Antonino; and van der Boom, Milko E.  Composite Molecular Assemblies: Nanoscale Structural Control and Spectroelectrochemical Diversity  J. Am. Chem. Soc., 135(44), 16533-16544 (2013).  [DOI: 10.1021/ja407659zExternal link] [CEES]
938.Du, Peng; Lu, Jun; Lau, Kah Chun; Luo, Xiangyi; Bareno, Javier; Zhang, Xiaoyi; Ren, Yang ; Zhang, Zhengcheng; Curtiss, Larry A; Sun, Yang-Kook; and Amine, Khalil  Compatibility of lithium salts with solvent of the non-aqueous electrolyte in Li–O2 batteries  Phys. Chem. Chem. Phys., 15, 5572-5581 (2013).  [DOI: 10.1039/C3CP50500FExternal link] [CEES]
939.Fister, T. T.; Fuoss, P. H.; Fong, Dillon D.; Eastman, J. A.; Folkman, Chad; Hruszkewycz, Stephan O.; Highland, Matthew; Hua, Zhou; and Fenter, Paul  Surface diffraction on a psi-circle diffractometer using the χ-axis geometry  J. Appl. Crystallogr., 46, (2013).  [DOI: 10.1107/S0021889813007693External link] [CEES]
940.Fister, T. T.; Goldman, Jason L.; Long, Brandon R.; Nuzzo, Ralph G; Gewirth, Andrew A.; and Fenter, Paul  X-ray Diffraction Microscopy of Lithiated Silicon Microstructures  Appl. Phys. Lett., 102, 131903 (2013).  [DOI: 10.1063/1.4798554External link] [CEES]
941.Folkman, C. M.; Highland, M. J.; Perret, E.; Kim, S. K.; Fister, T. T.; Zhou, H.; Baldo, P. M.; Seifert, S.; Eastman, J. A.; Fuoss, P. H.; and Fong, D. D.  Modular instrument mounting system for variable environment in operando X-ray experiments  Rev. Sci. Instrum., 84, 025111 (2013).  [DOI: 10.1063/1.4791799External link] [CEES]
942.Goldman, Jason L.; Cason, Michael W.; Wetzel, David J.; Vieker, Henning; Beyer, Andre; Golzhauser, Armin; Gewirth, Andrew A.; and Nuzzo, Ralph G.  Directed Transport as a Route to Improved Performance in Micropore-Modified Encapsulated Multilayer Silicon Electrodes  J. Electrochem. Soc., 160, A1746-A1752 (2013).  [DOI: 10.1149/2.047310jesExternal link] [CEES]
943.Grindy, Scott; Meredig, Bryce; Kirklin, Scott; Saal, James E.; and Wolverton, Christopher  Approaching chemical accuracy with density functional calculations: Diatomic energy corrections  Phys. Rev. B, 87, 075150 (2013).  [DOI: 10.1103/PhysRevB.87.075150External link] [CEES]
944.Hao, Shiqiang; and Wolverton, Christopher  Lithium transport in amorphous Al2O3 and AlF3 for discovery of battery coatings  J. Phys. Chem. C, , (2013).  [DOI: 10.1021/jp311982dExternal link] [CEES]
945.Huff, Laura A.; Rapp, Jennifer L.; Zhu, Lingyang; and Gewirth, Andrew A.  Identifying Lithium-Air Battery Discharge Products through 6Li Solid-State MAS and 1H-13C Solution NMR Spectroscopy  J. Power Sources, 235, 87-94 (2013).  [DOI: 10.1016/j.jpowsour.2013.01.158External link] [CEES]
946.Kaitz, Joshua A.; Diesendruck, C. E.; and Moore, Jeffrey S.  End group characterization of poly(phthalaldehyde): Surprising discovery of a reversible, cationic macrocyclization mechanism  J. Am. Chem. Soc, 135, 12755-12761 (2013).  [DOI: 10.1021/ja405628gExternal link] [CEES]
947.Kaitz, Joshua A.; and Moore, Jeffrey S.  Functional Phthalaldehyde Polymers by Copolymerization with Substituted Benzaldehydes  Macromolecules, 46, 608-612 (2013).  [DOI: 10.1021/ma302575sExternal link] [CEES]
948.Kaminker, Revital; de Hatten, Xavier; Lahav, Michal; Lupo, Fabio; Gulino, Antonino; Evmenenko, Guennadi; Dutta, Pulak; Browne, Colm; Nitschke, Jonathan R.; and van der Boom, Milko E.  Assembly of Surface-Confined Homochiral Helicates: Chiral Discrimination of DOPA and Unidirectional Charge Transfer  J. Am. Chem. Soc., 135(45), 17052-17059 (2013).  [DOI: 10.1021/ja4077205External link] [CEES]
949.Kirklin, Scott; Meredig, Bryce; and Wolverton, Christopher  High-Throughput Computational Screening of New Li-Ion Battery Anode Materials  Adv. Energy Mater., 3, 252-262 (2013).  [DOI: 10.1002/aenm.201200593External link] [CEES]
950.Lei, Yu; Lu, Jun; Luo, Xiangyi; Wu, Tianpin; Du, Peng; Zhang, Xiaoyi; Ren, Yang ; Wen, Jianguo; Miller, Dean J.; Miller, Jeffrey T; Sun, Yang-Kook; Elam, Jeffrey W.; and Amine, Khalil  Synthesis of Porous Carbon Supported Palladium Nanoparticle Catalysts by Atomic Layer Deposition: Application for Rechargeable Lithium–O2 Battery  Nano Lett., 13(9), 4182-4189 (2013).  [DOI: 10.1021/nl401833pExternal link] [CEES]
951.Lipson, Albert L.; and Hersam, Mark C.  Conductive scanning probe characterization and nanopatterning of electronic and energy materials  J. Phys. Chem. C, , (2013).  [DOI: 10.1021/jp312594sExternal link] [CEES]
952.Long, Brandon R.; Goldman, Jason L.; Nuzzo, Ralph G.; and Gewirth, Andrew A.  Model Ge microstructures as anodes for Li-ion batteries  J.. Solid State Electrochem., 17(12), 3015-3020 (2013).  [DOI: 10.1007/s10008-013-2148-6External link] [CEES]
953.Lu, Jun; Lei, Yu; Lau, Kah Chun; Luo, Xiangyi; Du, Peng; Wen, Jianguo; Assary, Rajeev S.; Das, Ujjal; Miller, Dean J.; Elam, Jeffrey W.; Albishri, Hassan M.; El-Hady, D. Abd; Sun, Yang-Kook; Curtiss, Larry A; and Amine, Khalil  A Nanostructured Cathode Architecture for Low Charge Overpotential in Lithium-Oxygen Batteries  Nat. Comm., 4, 2383 (2013).  [DOI: 10.1038/ncomms3383External link] [CEES]
954.Lu, Jun; Jung, Hun-Ji; Lau, Kah Chun; Zhang, Zhengcheng; Schlueter, J.A.; Du, Peng; Assary, Rajeev S.; Greeley, Jeffrey P; Ferguson, Glen A.; Wang, Hsien-Hau; Hassoun, Jusef; Iddir, H.; Zhou, Jigang; Zuin, Lucia; Hu, Yongfeng; Sun, Yang-Kook; Scrosati, Bruno; Curtiss, Larry A; and Amine, Khalil  Magnetism in Lithium–Oxygen Discharge Product  ChemSusChem, 6, 1196-1202 (2013).  [DOI: 10.1002/cssc.201300223External link] [CEES]
955.Parsons, Gregory N.; Elam, Jeffrey W.; George, Steven M; Haukka, Suvi; Jeon, Hyeongtag; Kessels, W.M.M. (Erwin); Leskela, Markku; Poodt, Paul; Ritala, Mikko; and Rossenagel, Steven M.  History of atomic layer deposition and its relationship with the American Vacuum Society   J. Vac. Sci. Technol. A, 31(5), 050818-1-0508180-11 (2013).  [DOI: 10.1116/1.4816548External link] [CEES]
956.Pol, Vilas G.; Wen, Jianguo; Lau, Kah Chun; Callear, Samantha; Bowron, Daniel T.; Lin, Chi-Kai; Deshmukh, Sanket A.; Sankaranarayanan, Subramanian; Curtiss, Larry A; David, William I.F.; Miller, Dean J.; and Thackeray, Michael  Probing the evolution and morphology of hard carbon spheres  Carbon, , (2013).  [DOI: 10.1016/j.carbon.2013.10.059External link] [CEES]
957.Saal, James E.; Kirklin, Scott; Aykol, Muratahan; Meredig, Bryce; and Wolverton, Christopher  Materials Design and Discovery with High-Throughput Density Functional Theory: The Open Quantum Materials Database (OQMD)  JOM, 65, 1501 (2013).  [DOI: 10.1007/s11837-013-0755-4External link] [CEES]
958.Seisenbaeva, Gulaim A.; Nedelec, Jean- Marie; Daniel, Geoffrey; Tiseanu, Carmen; Parvulescu, Vasile; Pol, Vilas G.; Abrego, Luis; and Kessler, Vadim G.  Mesoporous Anatase TiO2 Nanorods as Thermally Robust Anode Materials for Li-Ion Batteries: Detailed Insight into the Formation Mechanism  Chemistry, 19(51), 17439-17444 (2013).  [DOI: 10.1002/chem.201303283External link] [CEES]
959.Tavassol, Hadi; Chan, Maria K. Y.; Catarello, Maria; Greeley, Jeffrey P; Cahill, D.G.; and Gewirth, Andrew A.  Surface coverage and SEI induced electrochemical surface stress changes during Li deposition in Li-ion battery anodes  J. Electrochem. Soc., 160, A888-A896 (2013).  [DOI: 10.1149/2.068306jesExternal link] [CEES]
960.Thackeray, Michael; Chan, Maria K. Y.; Trahey, Lynn; Kirklin, Scott; and Wolverton, Christopher  A Vision for Designing High Energy, Hybrid Li-Ion/Li-O2 Cells  J. Phys. Chem. Lett., 4, 3607 (2013).  [DOI: 10.1021/jz4018464External link] [CEES]
961.Townsend, Joshua P; Chang, Yun-Yuan; Lou, Xiaoting; Merino, Miguel; Kirklin, Scott; Doak, J W; Issa, Ahmed; Wolverton, Christopher; Tkachev, Sergey N; Dera, Przemyslaw; and Jacobsen, Steven D.  Stability and equation of state of post-aragonite BaCO3  Physics and Chemistry of Minerals, 40, 447-453 (2013).  [DOI: 10.1007/s00269-013-0582-8External link] [CEES]
962.Trahey, Lynn; Karan, Naba K; Chan, Maria K. Y.; Lu, Jun; Ren, Yang ; Greeley, Jeffrey P; Balasubramanian, M.; Burrell, Anthony K.; Curtiss, Larry A; and Thackeray, Michael  Synthesis, Characterization, and Structural Modeling of High-Capacity, Dual Functioning MnO2 Electrode/Electrocatalysts for Li-O2 Cells  Adv. Energy Mater., 3, (2013).  [DOI: 10.1002/aenm.201200037External link] [CEES]
963.Weng, Wei; Pol, Vilas G.; and Amine, Khalil  Ultrasound Assisted Design of Sulfur/Carbon Cathodes with Partially Fluorinated Ether Electrolytes for Highly Efficient Li/S Batteries  Adv. Mater., 25, 1608-1615 (2013).  [DOI: 10.1002/adma.201204051External link] [CEES]
964.Weng, Wei; Zhang, Zhengcheng; Schlueter, J.A.; and Amine, Khalil  Synthesis and electrochemical property of sulfone-functionalized imidazolium ionic liquid electrolytes  Electrochim. Acta, 92, 392-396 (2013).  [DOI: 10.1016/j.electacta.2013.01.040External link] [CEES]
965.Zhan, Chun; Kropf, Jeremy; Wu, Tianpin; Jansen, Andrew N.; Sun, Yang-Kook; Qiu, Xinping; and Amine, Khalil  Mn(II) deposition on anodes and its effects on capacity fade in spinel lithium manganate–carbon systems  Nat. Comm., , (2013).  [DOI: 10.1038/ncomms3437External link] [CEES]
966.Zhang, Xiaofeng; Belharouak, Ilias; Li, Li; Lei, Yu; Elam, Jeffrey W.; Nie, Anmin; Chen, Xinqi; Yassar, Reza S.; and Axelbaum, Richard L.  Structural and Electrochemical Study of Al2O3 and TiO2 Coated Li1.2Ni0.13Mn0.54Co0.13O2 Cathode Material Using ALD  Adv. Energy Mater., 3, 1299-1307 (2013).  [DOI: 10.1002/aenm.201300269External link] [CEES]
967.Allen, J.; Green, W. H.; Li, Y.; Guo, H.; and Suleymanov, Y.  FULL DIMENSIONAL QUANTUM RATE COEFFICIENTS AND KINETIC ISOTOPE EFFECTS FROM RING POLYMER MOLECULAR DYNAMICS FOR A SEVEN-ATOM REACTION OH + CH4 → CH3 + H2O  Journal of Chemical Physics, 138, 22103 (2013).  [DOI: 10.1063/1.4811329External link] [CEFRC]
968.Brumfield, B.; Sun, Wenting; Ju, Yiguang; and Wysocki, G.  Direct In Situ Quantification of HO2 from a Flow Reactor  The Journal of Physical Chemistry Letters, 4, 872–876 (2013).  [DOI: 10.1021/jz400143cExternal link] [CEFRC]
969.Camacho, J.; Lieb, S.; and Wang, Hai  Evolution of size distributions of nascent soot in n- and i-butanol flames  Proc. Combust. Inst, 34, 1853-1860 (2013).  [DOI: 10.1016/j.proci.2012.05.100External link] [CEFRC]
970.Campbell, M. F.; Davidson, David F.; Hanson, Ronald K.; and Westbrook, Charles K.  Ignition Delay Times of Methyl Oleate and Methyl Linoleate Behind Reflected Shock Waves  Proc. Combust. Inst, 34, 419–425 (2013).  [DOI: 10.1016/j.proci.2012.05.084External link] [CEFRC]
971.Dames, Enoch; and Golden, D. M.  Master equation modeling of the unimolecular decompositions of hydroxymethyl (CH2OH) and methyoxy (CH3O) radicals to formaldehyde (CH2O)+H  Journal of Physical Chemistry, 117, 7686-96 (2013).  [DOI: 10.1021/jp404836mExternal link] [CEFRC]
972.Dames, Enoch; and Wang, Hai  Isomerization kinetics of benzylic and methylphenyl type radicals in single-ring aromatics  Proc. Combust. Inst, 34, 307–314 (2013).  [DOI: 10.1016/j.proci.2012.05.014External link] [CEFRC]
973.Dempsey, A.; Walker, N.; Gingrich, E.; and Reitz, R. D.  COMPARISON OF LOW TEMPERATURE COMBUSTION STRATEGIES FOR ADVANCED COMPRESSION IGNITION ENGINES WITH A FOCUS ON CONTROLLABILITY  Combustion Science and Technology, 186, 210-241 (2013).  [DOI: 10.1080/00102202.2013.858137External link] [CEFRC]
974.Dempsey, A.; Walker, N.; and Reitz, R. D.  Effect of Cetane Improvers on Gasoline, Ethanol, and Methanol Reactivity and the Implications for RCCI Combustion  SAE Int. J. Fuels Lubr, 6, 170-187 (2013).  [DOI: 10.4271/2013-01-1678External link] [CEFRC]
975.Dempsey, A.; Walker, N.; and Reitz, R. D.  Effect of Piston Bowl Geometry on Dual Fuel Reactivity Controlled Compression Ignition (RCCI) in a Light-Duty Engine Operated with Gasoline/Diesel and Methanol/Diesel  SAE Int. J. Engines, 6, 78-100 (2013).  [DOI: 10.4271/2013-01-0264External link] [CEFRC]
976.Dievart, P. ; Won, Sang Hee; Gong, J.; Dooley, S.; and Ju, Yiguang  A Comparative Study of Chemical Kinetic Characteristics of Methyl Esters in Diffusion Flame Extinction  Proc. Combust. Inst, 34, 821-829 (2013).  [DOI: 10.1016/j.proci.2012.06.180External link] [CEFRC]
977.El-Asrag, J. A.; and Ju, Yiguang  Direct Numerical Simulations of Exhaust Gas Recirculation on Multistage Autoignition in the Negative Temperature Combustion Regime for A Stratified Flow by Using H2O2 Addition  Combustion Theory and Modeling, 17, 316-334 (2013).  [DOI: 10.1080/13647830.2013.764020External link] [CEFRC]
978.Gou, Xiaolong; Chen, Z.; Sun, Wenting; and Ju, Yiguang  A Dynamic Adaptive Chemistry Scheme with Error Control for Combustion Modeling with a Large Detailed Mechanism  Combustion and Flame, 160, 225-231 (2013).  [DOI: 10.1016/j.combustflame.2012.10.015External link] [CEFRC]
979.Guo, Huijin; Sun, Wenting; Haas, F. M.; Dryer, F. L. ; and Ju, Yiguang  Measurements of H2O2 in Low Temperature Dimethyl Ether Oxidation  Proc. Combust. Inst, 34, 573-581 (2013).  [DOI: 10.1016/j.proci.2012.05.056External link] [CEFRC]
980.Hansen, N.; Merchant, S. S.; Harper, M. R.; and Green, W. H.  The Predictive Capability of an Automatically Generated Combustion Chemistry Mechanism: Chemical Structures of Premixed iso-Butanol Flames  Combust. Flame, 160, 2343-2351 (2013).  [DOI: 10.1016/j.combustflame.2013.05.013External link] [CEFRC]
981.Heyne, J. S.; Dooley, S.; and Dryer, F. L.  Dehydration Rate Measurements for tertiary-Butanol in a Variable Pressure Flow Reactor  J. Phys. Chem. A, 117, 8997–9004 (2013).  [DOI: 10.1021/jp404143fExternal link] [CEFRC]
982.Heyne, J. S.; and Dryer, F. L.  Uncertainty Analysis in the Use of Chemical Thermometry: A Case Study with Cyclohexene  J. Phys. Chem. A, 117, 5401–5406 (2013).  [DOI: 10.1021/jp402982yExternal link] [CEFRC]
983.Jalan, A.; Alecu, I. M.; Meana-Paneda, R.; Aguilera-Iparraguirre, J.; Yang, K. R. ; Merchant, S. S.; Truhlar, D. G.; and Green, W. H.  NEW PATHWAYS FOR FORMATION OF ACIDS AND CARBONYL PRODUCTS IN LOW-TEMPERATURE OXIDATION: THE KORCEK DECOMPOSITION OF Γ-KETOHYDROPEROXIDES  Journal of the American Chemical Society, 135, 11100-11114 (2013).  [DOI: 10.1021/ja4034439External link] [CEFRC]
984.Jalan, A.; West, R. H.; and Green, W. H.  An Extensible Framework for Capturing Solvent Effects in Computer Generated Kinetic Models  Journal of Physical Chemistry, 117, 2955–2970 (2013).  [DOI: 10.1021/jp310824hExternal link] [CEFRC]
985.Kéromnès, A.; Metcalfe, W. K.; Heufer, K. A.; Donohoe, N.; Das, A. K.; Sung, C. J.; Herzler, J.; Naumann, C.; Griebel, P.; Mathieu, O.; Krejci, M. C.; Petersen, E. L.; Pitz, W. J.; and Curran, H. J.  An Experimental and Detailed Chemical Kinetic Modelling Study of Hydrogen and Syngas Mixtures at Elevated Pressures  Combustion and Flame, 160, 995-1011 (2013).  [DOI: 10.1016/j.combustflame.2013.01.001External link] [CEFRC]
986.Kim, H. H.; Won, Sang Hee; Santner, J.; Chen, Z.; and Ju, Yiguang  Measurements of the Critical Initiation Radius and Unsteady Propagation of n-Decane/Air Premixed Flames  Proc. Combust. Inst, 34, 929-936 (2013).  [DOI: 10.1016/j.proci.2012.07.035External link] [CEFRC]
987.Lam, K. Y.; Davidson, David F.; and Hanson, Ronald K.  A Shock Tube Study of H2+OH→H2O+H using OH Laser Absorption  International Journal of Chemical Kinetics, 45, 363-373 (2013).  [DOI: 10.1002/kin.20771External link] [CEFRC]
988.Lefkowitz, J. K.; Won, Sang Hee; Fenard, Y.; and Ju, Yiguang  Uncertainty Assessment of Species Measurements in Acetone Counterflow Diffusion Flames  Proc. Combust. Inst, 34, 813-820 (2013).  [DOI: 10.1016/j.proci.2012.05.055External link] [CEFRC]
989.Li, S.; Dames, Enoch; Davidson, David F.; and Hanson, Ronald K.  HIGH-TEMPERATURE MEASUREMENTS OF THE REACTIONS OF OH WITH ETHYLAMINE AND DIMETHYLAMINE  Journal Physical Chemistry A, 118, 70–77 (2013).  [DOI: 10.1021/jp411141wExternal link] [CEFRC]
990.Li, Yongle; Suleymanov, Y.; Li, Jun; Green, W. H.; and Guo, Hua  Rate coefficients and kinetic isotope effects of the X + CH4 → CH3 + HX (X= H, D, Mu) reactions from ring polymer molecular dynamics  Journal of Physical Chemistry, 138, (2013).  [DOI: 10.1063/1.4793394External link] [CEFRC]
991.Liu, D.; Santner, J.; Togbe, C.; Felsmann, D.; Koppmann, J.; Lackner, A.; Yang, Xueliang; Shen, Xiaobo; Ju, Yiguang; and Kohse-Hoinghaus, K.  FLAME STRUCTURE AND KINETIC STUDIES OF CARBON DIOXIDE-DILUTED DIMETHYL ETHER FLAMES AT REDUCED AND ELEVATED PRESSURES  Combustion and Flame, 160, 2654-2668 (2013).  [DOI: 10.1016/j.combustflame.2013.06.032External link] [CEFRC]
992.Merchant, S. S.; Zanoelo, E. F.; Speth, R. L.; Harper, M. R.; Van Geem, K. M.; and Green, W. H.  COMBUSTION AND PYROLYSIS OF ISO-BUTANOL: EXPERIMENTAL AND CHEMICAL KINETIC MODELING STUDY  Combustion & Flame, 160, 1907-1929 (2013).  [DOI: 10.1016/j.combustflame.2013.04.023External link] [CEFRC]
993.Niemeyer, K. E.; and Sung, C. J.  Recent Progress and Challenges in Exploiting Graphics Processors in Computational Fluid Dynamics  The Journal of Supercomputing, , (2013).  [DOI: 10.1007/s11227-013-1015-7External link] [CEFRC]
994.Nikraz, S.; and Wang, Hai  Dye sensitized solar cells prepared by flames stabilized on a rotating surface  Proceedings of the Combustion Institute, 34, 2171-2178 (2013).  [DOI: 10.1016/j.proci.2012.06.069External link] [CEFRC]
995.Park, O.; Veloo, Peter S.; and Egolfopoulos, Fokion N.  Flame studies of C2 hydrocarbons  Proc. Combust. Inst, 34, 711-718 (2013).  [DOI: 10.1016/j.proci.2012.06.159External link] [CEFRC]
996.Pope, Stephen B.  Small scales, many species and the manifold challenges of turbulent combustion  Proc. Combust. Inst, 34, 1-31 (2013).  [DOI: 10.1016/j.proci.2012.09.009External link] [CEFRC]
997.Reitz, R. D.  Directions in Internal Combustion Engine Research  Combustion and Flame, 160, 1-8 (2013).  [DOI: 10.1016/j.combustflame.2012.11.002External link] [CEFRC]
998.Ren, W.; Dames, Enoch; Hyland, D.; Davidson, David F.; and Hanson, Ronald K.  Shock Tube Study of Methanol, Methyl Formate Pyrolysis: CH3OH and CO Time-History Measurements  Combustion and Flame, 160, 2669-2679 (2013).  [DOI: 10.1016/j.combustflame.2013.06.016External link] [CEFRC]
999.Ren, W.; Lam, K. Y.; Pyun, S. H.; Farooq, A.; Davidson, David F.; and Hanson, Ronald K.  Shock Tube/Laser Absorption Studies of the Decomposition of Methyl Formate  Proc. Combust. Inst, 34, 453–461 (2013).  [DOI: 10.1016/j.proci.2012.05.071External link] [CEFRC]
1000.Rosado-Reyes, C.; Tsang, W.; Alecu, I. M.; Merchant, S. S.; and Green, W. H.  DEHYDRATION OF ISOBUTANOL AND THE ELIMINATION OF WATER FROM FUEL ALCOHOLS  Journal of Physical Chemistry, , (2013).  [DOI: 10.1021/jp4045513External link] [CEFRC]
Last modified: 9/17/2014 6:59:08 PM