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Submissions from 2018

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Characterizing virus-induced gene silencing at the cellular level with in situ multimodal imaging, Sadie J. Burkhow, Nicole M. Stephens, Yu Mei, Maria Emilia Duenas, Daniel J. Freppon, Geng Ding, Shea C. Smith, Young-Jin Lee, Basil J. Nikolau, Steven A. Whitham, and Emily A. Smith

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Pore diameter dependence of catalytic activity: p-nitrobenzaldehyde conversion to an aldol product in amine-functionalized mesoporous silica, Andres Garcia, Igor I. Slowing, and James W. Evans

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Theoretical prediction of crystallization kinetics of a supercooled Lennard-Jones fluid, K. G. S. H. Gunawardana and Xueyu Song

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Revealing Individual Lifestyles through Mass Spectrometry Imaging of Chemical Compounds in Fingerprints, Paige Hinners, Kelly C. O’Neill, and Young Jin Lee

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The ACS Exams Institute Undergraduate Chemistry Anchoring Concepts Content Map IV: Physical Chemistry, Thomas A. Holme, Jessica J. Reed, Jeffrey R. Raker, and Kristen L. Murphy

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Spatial distribution of organic functional groups supported on mesoporous silica nanoparticles (2): a study by 1H triple-quantum fast-MAS solid-state NMR, Takeshi Kobayashi, Dilini Singappuli-Arachchige, Igor I. Slowing, and Marek Pruski

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Spatial–temporal spectroscopy characterizations and electronic structure of methylammonium perovskites, Zhaoyu Liu, K. C. Bhamu, Liang Luo, Satvik Shah, Joong-Mok Park, Di Cheng, Men Long, Rana Biswas, F. Fungara, Ruth Shinar, Joseph Shinar, Javier Vela, and Jigang Wang

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The ACS Exams Institute Undergraduate Chemistry Anchoring Concepts Content Map III: Inorganic Chemistry, Keith A. Marek, Jeffery R. Raker, Thomas A. Holme, and Kristen L. Murphy

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Open Resonance Assisted Hydrogen Bonds and Competing Quasiaromaticity, Yen H. Nguyen, Bryan J. Lampkin, Amrit Venkatesh, Arkady Ellern, Aaron J. Rossini, and Brett VanVeller

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Chemical Imaging of Cyanoacrylate‐Fumed Fingerprints by Matrix‐assisted Laser Desorption/Ionization Mass Spectrometry Imaging, Kelly C. O'Neill, Paige Hinners, and Young Jin Lee

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Direct 17O Dynamic Nuclear Polarization of Single-Site Heterogeneous Catalysts, Frederic A. Perras, Kasuni Chathurika Boteju, Igor Ivan Slowing, Aaron D. Sadow, and Marek Pruski

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Materials Characterization by Dynamic Nuclear Polarization Enhanced Solid-State NMR Spectroscopy, Aaron Rossini

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Quantitative atomic-scale structure characterization of ordered mesoporous carbon materials by solid state NMR, Zhuoran Wang, Naftali Opembe, Takeshi Kobayashi, Nicholas C. Nelson, Igor I. Slowing, and Marek Pruski

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Expanding the I-II-V Phase Space: Soft Synthesis of Polytypic Ternary and Binary Zinc Antimonides, Miles A. White, Katelyn J. Baumler, Yunhua Chen, Amrit Venkatesh, Alan M. Medina-Gonzalez, Aaron Rossini, Julia Zaikina, Emory Chan, and Javier Vela

Submissions from 2017

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Spatial Mapping and Profiling of Metabolite Distributions During Germination, Robbyn Anand, Adam D. Feenstra, Liza E. Alexander, Zhihong Song, Andrew R. Korte, Marna D. Yandeau-Nelson, Basil J. Nikolau, and Young-Jin Lee

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High-Throughput Selective Capture of Single Circulating Tumor Cells by Dielectrophoresis at a Wireless Electrode Array, Robbyn Anand and Min Li

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Using ATTO Dyes To Probe the Photocatalytic Activity of Au−CdS Nanoparticles, Ujjal Bhattacharjee, Long Men, Bryan A. Rosales, Samuel R. Alvarado, Javier Vela, and Jacob W. Petrich

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Germanium–Tin/Cadmium Sulfide Core/Shell Nanocrystals with Enhanced Near-Infrared Photoluminescence, Brett W. Boote, Long Men, Himashi P. Andaraarachchi, Ujjal Bhattacharjee, Jacob W. Petrich, Javier Vela, and Emily A. Smith

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Electropolymerized Pyrrole Based Conductive Polymeric Ionic Liquids and their Application for Solid-Phase Microextraction, Amila M. Devasurendra, Cheng Zhang, Joshua A. Young, L. M. Viranga Tillekeratne, Jared L. Anderson, and Jon R. Kirchoff

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3D MALDI Mass Spectrometry Imaging of a Single Cell: Spatial Mapping of Lipids in the Embryonic Development of Zebrafish, Maria Emilia Duenas, Jeffrey J. Essner, and Young Jin Lee

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β-SiH-Containing Tris(silazido) Rare-Earth Complexes as Homogeneous and Grafted Single-Site Catalyst Precursors for Hydroamination, Naresh Eedugurala, Zhuoran Wang, KaKing Yan, Kasuni Boteju, Umesh Chaudhary, Takeshi Kobayashi, Arkady Ellern, Igor I. Slowing, Marek Pruski, and Aaron D. Sadow

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Tailoring Nanoscale Morphology of Polymer: Fullerene Blends Using Electrostatic Field, Moneim Elshobaki, Ryan S. Gebhardt, John Carr, William Lindemann, Wenjie Wang, Eric Grieser, Swaminathan Venkatesan, Evan Ngo, Ujjal Bhattacharjee, Joseph Strzalka, Zhang Jiang, Qiquan Qiao, Jacob W. Petrich, David Vaknin, and Sumit Chaudhary

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Identification and characterization of small molecule inhibitors of porcine reproductive and respiratory syndrome virus, Alyssa B. Evans, Pengfei Dong, Hyelee Loyd, Jianqiang Zhang, George A. Kraus, and Susan Carpenter

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Anomalous effect of non-alternant hydrocarbons on carbocation and carbanion electronic configurations, Logan J. Fischer, Andrew S. Dutton, and Arthur H. Winter

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Photophysical properties of wavelength-tunable methylammonium lead halide perovskite nanocrystals, Daniel J. Freppon, Long Men, Sadie J. Burkhow, Jacob W. Petrich, Javier Vela, and Emily A. Smith

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Enhancing the resolution of 1H and 13C solid-state NMR spectra by reduction of anisotropic bulk magnetic susceptibility broadening, Michael P. Hanrahan, Amrit Venkatesh, Scott L. Carnahan, Julie L. Calahan, Joseph W. Lubach, Eric J. Munson, and Aaron Rossini

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The Solvent- Solid Interface of Acid Catalysts Studied by High Resolution MAS NMR, Robert L. Johnson, Michael P. Hanrahan, Max Mellmer, James A. Dumesic, Aaron J. Rossini, and Brent H. Shanks

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Improved strategies for DNP-enhanced 2D 1H-X heteronuclear correlation spectroscopy of surfaces, Takeshi Kobayashi, Frédéric A. Perras, Umesh Chaudhary, Igor I. Slowing, Wenyu Huang, Aaron D. Sadow, and Merek Pruski

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Polar Intermetallics Pr5Co2Ge3 and Pr7Co2Ge4 with Planar Hydrocarbon‐Like Metal Clusters, Qisheng Lin, Kaiser Aguirre, Scott M. Saunders, Timothy A. Hackett, Yong Liu, Valentin Taufour, Durga Paudyal, Sergey L. Bud’ko, Paul C. Canfield, and Gordon J. Miller

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Metal–Organic‐Framework‐Derived Carbons: Applications as Solid‐Base Catalyst and Support for Pd Nanoparticles in Tandem Catalysis, Xinle Li, Biying Zhang, Yuhui Fang, Weijun Sun, Zhiyuan Qi, Yuchen Pei, Shuyan Qi, Pengyu Yuan, Xuechen Luan, Tian Wei Goh, and Wenyu Huang

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Beyond “Inert” Ideas to Teaching General Chemistry from Rich Contexts: Visualizing the Chemistry of Climate Change (VC3), Peter G. Mahaffy, Thomas A. Holme, Leah Martin-Visscher, Brian E. Martin, Ashley Versprille, Mary Kirchhoff, Lallie McKenzie, and Marcy Towns

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Transfer hydrogenation over sodium-modified ceria: Enrichment of redox sites active for alcohol dehydrogenation, Nicholas C. Nelson, Brett W. Boote, Pranjali Naik, Aaron Rossini, Emily A. Smith, and Igor I. Slowing

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Morphology inherence from hollow MOFs to hollow carbon polyhedrons in preparing carbon-based electrocatalysts, Yuchen Pei, Zhiyuan Qi, Xinle Li, Raghu V. Maligal-Ganesh, Tian Wei Goh, Chaoxian Xiao, Tianyu Wang, and Wenyu Huang

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Indirect detection of infinite-speed MAS solid-state NMR spectra, Frederic A. Perras, Amrit Venkatesh, Michael P. Hanrahan, Tian Wei Goh, Wenyu Huang, Aaron Rossini, and Marek Pruski

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Cerium-Catalyzed Hydrosilylation of Acrylates to Give α-Silyl Esters, Aradhana Pindwal, Smita Patnaik, William C. Everett, Arkady Ellern, Theresa L. Windus, and Aaron D. Sadow

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Sub-4 nm PtZn Intermetallic Nanoparticles for Enhanced Mass and Specific Activities in Catalytic Electrooxidation Reaction, Zhiyuan Qi, Chaoxian Xiao, Cong Liu, Tian Wei Goh, Lin Zhou, Raghu V. Maligal-Ganesh, Yuchen Pei, Xinle Li, Larry A. Curtiss, and Wenyu Huang

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A flexible route to bioactive 6-alkyl-α-pyrones, Yang Qu and George A. Kraus

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Analyzing the Role of Science Practices in ACS Exam Items, Jessica J. Reed, Alexandra R. Brandriet, and Thomas A. Holme

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Lead halide perovskites: Challenges and opportunities in advanced synthesis and spectroscopy, Bryan A. Rosales, Michael P. Hanrahan, Brett W. Boote, Aaron Rossini, Emily A. Smith, and Javier Vela

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Homoleptic organolanthanide compounds supported by the bis(dimethylsilyl)benzyl ligand, Aaron D. Sadow, Kasuni C. Boteju, and Arkady Ellern

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Photon Counting Data Analysis: Application of the Maximum Likelihood and Related Methods for the Determination of Lifetimes in Mixtures of Rose Bengal and Rhodamine B, Kalyan Santra, Emily A. Smith, Jacob W. Petrich, and Xueyu Song

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Direct 3D Printing of Catalytically Active Structures, Igor I. Slowing, J. Sebastian Manzano, Zachary B. Weinstein, and Aaron D. Sadow

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Crystal structure, homogeneity range and electronic structure of rhombohedral γ-Mn5Al8, Srinivasa Thimmaiah, Zachary Tener, Tej N. Lamichhane, Paul C. Canfield, and Gordon J. Miller

A molecular Debye-Hückel theory and its applications to electrolyte solutions: The size asymmetric case, Tiejen Xiao and Xueyu Song

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Packing of Russian doll clusters to form a nanometer-scale CsCl-type compound in a Cr–Zn–Sn complex metallic alloy, Weiwei Xie, Robert J. Cava, and Gordon J. Miller

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Solvent suppression in DNP enhanced solid state NMR, Jayasubba Reddy Yarava, Sachin Rama Chaudhari, Aaron J. Rossini, Anne Lesage, and Lyndon Emsley

DNP-Enhanced Solid-State NMR Spectroscopy of Active Pharmaceutical Ingredients, Li Zhao, Arthur C. Pinon, Lyndon Emsley, and Aaron J. Rossini

Submissions from 2016

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Molecularly Responsive Binding through Co-occupation of Binding Space: A Lock–Key Story, Joseph K. Awino, Lan Hu, and Yan Zhao

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Characterizing Electric Field Exposed P3HT Thin Films Using Polarized‐Light Spectroscopies, Ujjal Bhattacharjee, Moneim Elshobaki, Kalyan Santra, Jonathan M. Bobbitt, Sumit Chaudhary, Emily A. Smith, and Jacob W. Petrich

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Sample Preparation for Bioanalytical and Pharmaceutical Analysis, Kevin D. Clark, Cheng Zheng, and Jared L. Anderson

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Catalytic Conversion Reactions in Nanoporous Systems with Concentration-Dependent Selectivity: Statistical Mechanical Modeling, Andrés García, Jing Wang, Theresa L. Windus, Aaron D. Sadow, and James W. Evans

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Enantioselective dearomative [3 + 2] cycloadditions of indoles with azomethine ylides derived from alanine imino esters, Anthony L. Gerten and Levi M. Stanley

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Recent advances in transition metal-catalysed hydroacylation of alkenes and alkynes, Avipsa Ghosh, Kirsten F. Johnson, Kevin L. Vickerman, James A. Walker Jr., and Levi M. Stanley

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Derivation and Implementation of the Gradient of the R–7 Dispersion Interaction in the Effective Fragment Potential Method, Emilie B. Guidez, Peng Xu, and Mark S. Gordon

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Solution-Processed BiI3 Thin Films for Photovoltaic Applications: Improved Carrier Collection via Solvent Annealing, Umar H. Hamdeh, Rainie D. Nelson, Bradley J. Ryan, Ujjal Bhattacharjee, Jacob W. Petrich, and Matthew G. Panthani

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35 Cl dynamic nuclear polarization solid-state NMR of active pharmaceutical ingredients, David A. Hirsh, Aaron J. Rossini, Lyndon Emsley, and Robert W. Schurko

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Light-up and FRET aptamer reporters; evaluating their applications for imaging transcription in eukaryotic cells, Muslum Ilgu, Judhajeet Ray, Lee Bendickson, Tianjiao Wang, Ivan Geraskin, George A. Kraus, and Marit Nilsen-Hamilton

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Superconducting Properties of Rh 9 In 4 S 4 Single Crystals, Udhara S. Kaluarachchi, Qisheng Lin, Weiwei Xie, Valentin Taufour, S. L. Bud’ko, Gordon J. Miller, and Paul C. Canfield

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DNP-Enhanced Ultrawideline Solid-State NMR Spectroscopy: Studies of Platinum in Metal–Organic Frameworks, Takeshi Kobayashi, Frédéric A. Perras, Tian Wei Goh, Tanner L. Metz, Wenyu Huang, and Marek Pruski

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Physical Properties of Single Crystalline R Mg 2 Cu 9 ( R = Y , Ce − Nd , Gd − Dy , Yb ) and the Search for In-Plane Magnetic Anisotropy in Hexagonal Systems, Tai Kong, William R. Meier, Qisheng Lin, Scott M. Saunders, S. L. Bud’ko, Rebecca Flint, and Paul C. Canfield

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Recent advancements in ion concentration polarization, Min Li and Robbyn Anand

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Tuning Complexity by Lithiation: A Family of Intergrowth Structures Using Condensed hypho-Icosahedra in the Li-Doped Ca–Zn System, Qisheng Lin, Ran Zhu, and Gordon J. Miller

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Controlling Catalytic Properties of Pd Nanoclusters through Their Chemical Environment at the Atomic Level Using Isoreticular Metal–Organic Frameworks, Xinle Li, Tian Wei Goh, Lei Li, Zhiyong Guo, Xiao Cheng Zeng, and Wenyu Huang

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Impact of Linker Engineering on the Catalytic Activity of Metal–Organic Frameworks Containing Pd(II)–Bipyridine Complexes, Xinle Li, Ryan Van Zeeland, Raghu V. Maligal-Ganesh, Yuchen Pei, Gregory Power, Levi M. Stanley, and Wenyu Huang

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A Ship-in-a-Bottle Strategy To Synthesize Encapsulated Intermetallic Nanoparticle Catalysts: Exemplified for Furfural Hydrogenation, Raghu V. Maligal-Ganesh, Chaoxian Xiao, Tian Wei Goh, Lin-Lin Wang, Jeffrey Gustafson, Yuchen Pei, Zhiyuan Qi, Duane D. Johnson, Shiran Zhang, Franklin Feng Tao, and Wenyu Huang

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Electrochemical Conversion of Biologically Produced Muconic Acid: Key Considerations for Scale-Up and Corresponding Technoeconomic Analysis, John E. Matthiesen, Miguel Suástegui, Yutong Wu, Mothi Viswanathan, Yang Qu, Mingfeng Cao, Natalia Rodriguez-Quiroz, Adam Okerlund, George Kraus, D. Raj Raman, Zengyi Shao, and Jean-Philippe Tessonnier

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Synthetic Development of Low Dimensional Materials, Long Men, Miles A. White, Himashi P. Andaraarachchi, Bryan A. Rosales, and Javier Vela

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Enhancement of the Superconducting Gap by Nesting in CaKFe4As4: A New High Temperature Superconductor, Daixiang Mou, Tai Kong, William R. Meier, Felix Lochner, Lin-Lin Wang, Qisheng Lin, Yun Wu, S. L. Bud’ko, Ilya Eremin, Duane D. Johnson, Paul C. Canfield, and Adam Kaminski

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Extraction and Purification of DNA from Complex Biological Sample Matrices Using Solid-Phase Microextraction Coupled with Real-Time PCR, Omprakash Nacham, Kevin D. Clark, and Jared L. Anderson

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Deactivation of Ceria Supported Palladium through C–C Scission during Transfer Hydrogenation of Phenol with Alcohols, Nicholas C. Nelson, Juan Sebastian Manzano, and Igor I. Slowing

Tuning surface properties of amino-functionalized silica for metal nanoparticle loading: The vital role of an annealing process, Yuchen Pei, Chaoxian Xiao, Tian Wei Goh, Qianhui Zhang, Shannon Goes, Weijun Sun, and Wenyu Huang

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Probing surface hydrogen bonding and dynamics by natural abundance, multidimensional, 17O DNP-NMR spectroscopy, Frédéric A. Perras, Umesh Chaudhary, Igor I. Slowing, and Marek Pruski

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Homoleptic Divalent Dialkyl Lanthanide-Catalyzed Cross-Dehydrocoupling of Silanes and Amines, Aradhana Pindwal, Arkady Ellern, and Aaron D. Sadow

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Synthesis and Oxidation Catalysis of [Tris(oxazolinyl)borato]cobalt(II) Scorpionates, Regina R. Reinig, Debabrata Mukherjee, Zachary B. Weinstein, Weiwei Xie, Toshia Albright, Benjamin Baird, Tristan S. Gray, Arkady Ellern, Gordon J. Miller, Arthur H. Winter, Sergey L. Bud'ko, and Aaron D. Sadow

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Persistent Dopants and Phase Segregation in Organolead Mixed-Halide Perovskites, Bryan A. Rosales, Long Men, Sarah D. Cady, Michael P. Hanrahan, Aaron J. Rossini, and Javier Vela

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Specificity and ligand affinities of the cocaine aptamer: impact of structural features and physiological NaCl, Ashish Sachan, Muslum Ilgu, Aaron Kempema, George A. Kraus, and Marit Nilsen-Hamilton

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What Is the Best Method to Fit Time-Resolved Data? A Comparison of the Residual Minimization and the Maximum Likelihood Techniques As Applied to Experimental Time-Correlated, Single-Photon Counting Data, Kalyan Santra, Jinchun Zhan, Xueyu Song, Emily A. Smith, Namrata Vaswani, and Jacob W. Petrich

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Matrix assisted laser desorption/ionization-mass spectrometry imaging (MALDI-MSI) for direct visualization of plant metabolites in situ, Drew Sturtevant, Young-Jin Lee, and Kent D. Chapman

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Cu2ZnSnS4 Nanorods Doped with Tetrahedral, High Spin Transition Metal Ions: Mn2+, Co2+, and Ni2+, Michelle J. Thompson, Kyle J. Blakeney, Sarah D. Cady, Malinda D. Reichert, Joselyn Del Pilar-Albaladejo, Seth T. White, and Javier Vela

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MOF-253-Pd(OAc)2: a recyclable MOF for transition-metal catalysis in water, Ryan Van Zeeland, Xinle Li, Wenyu Huang, and Levi M. Stanley

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Hybrid Approaches to Structural Characterization of Conformational Ensembles of Complex Macromolecular Systems Combining NMR Residual Dipolar Couplings and Solution X‑ray Scattering, Vincenzo Venditti, Timothy K. Egnert, and G. Marius Clore

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Polytypism and Unique Site Preference in LiZnSb: A Superior Thermoelectric Reveals Its True Colors, Miles A. White, Gordon J. Miller, and Javier Vela

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The transition from the open minimum to the ring minimum on the ground state and on the lowest excited state of like symmetry in ozone: A configuration interaction study, Theresa Lynn Windus, Daniel Theis, Joseph Ivanic, and Klaus Ruedenberg

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Conversion of Levulinic Acid to γ-Valerolactone over Few-Layer Graphene-Supported Ruthenium Catalysts, Chaoxian Xiao, Tian Wei Goh, Zhiyuan Qi, Shannon Goes, Kyle Brashler, Christopher Perez, and Wenyu Huang

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Large Scale Nanoparticle Screening for Small Molecule Analysis in Laser Desorption Ionization Mass Spectrometry, Gargey B. Yagnik, Rebecca L. Hansen, Andrew R. Korte, Malinda D. Reichert, Javier Vela, and Young-Jin Lee

Submissions from 2015

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A Fine Line Separates Carbocations from Diradical Ions in Donor-Unconjugated Cations, Toshia R. Albright and Arthur Winter

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Assessing Phosphine−Chalcogen Bond Energetics from Calculations, Samuel R. Alvarado, Ian A. Shortt, Hua-Jun Fan, and Javier Vela

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Phase-Programmed Nanofabrication: Effect of Organophosphite Precursor Reactivity on the Evolution of Nickel and Nickel Phosphide Nanocrystals, Himashi P. Andaraarachchi, Michelle J. Thompson, Miles A. White, Hua-Jun Fan, and Javier Vela

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Polymeric Nanoparticle Receptors as Synthetic Antibodies for Nonsteroidal Anti-Inflammatory Drugs (NSAIDs), Joseph K. Awino and Yan Zhao

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Preface: Special Topic on Supramolecular Self-Assembly at Surfaces, Ludwig Bartels, Karl-Heinz Ernst, Hong-Jun Gao, and Patricia A. Thiel

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Development of the Exams Data Analysis Spreadsheet as a Tool To Help Instructors Conduct Customizable Analyses of Student ACS Exam Data, Alexandra Brandriet and Thomas Holme

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Methods for Addressing Missing Data with Applications from ACS Exams, Alexandra Brandriet and Thomas Holme

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A Historical Investigation into Item Formats of ACS Exams and Their Relationships to Science Practices, Alexandra Brandriet, Jessica J. Reed, and Thomas Holme

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Multishell Au/Ag/SiO2 Nanorods with Tunable Optical Properties as Single Particle Orientation and Rotational Tracking Probes, Kuangcai Chen, Chia-Cheng Lin, Javier Vela, and Ning Fang

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Effective evaluation of catalytic deoxygenation for in situ catalytic fast pyrolysis using gas chromatography–high resolution mass spectrometry, D. Paul Cole and Young-Jin Lee

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Modeling Systems with π–π Interactions Using the Hartree–Fock Method with an Empirical Dispersion Correction, Justin A. Conrad and Mark S. Gordon

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Silanol-Assisted Carbinolamine Formation in an Amine-Functionalized Mesoporous Silica Surface: Theoretical Investigation by Fragmentation Methods, Ana P. de Lima Batista, Federico Zahariev, Igor I. Slowing, Ataualpa A. C. Braga, Fernando R. Ornellas, and Mark S. Gordon

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Linear Metal Chains in Ca2M2X (M = Pd, Pt; X = Al, Ge): Origin of the Pairwise Distortion and Its Role in the Structure Stability, Isa Doverbratt, Simeon Ponou, Yuemei Zhang, Sven Lidin, and Gordon J. Miller

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Tandem Alkyne Hydroacylation and Oxo-Michael Addition: Diastereoselective Synthesis of 2,3-Disubstituted Chroman-4-ones and Fluorinated Derivatives, Xiang-Wei Du and Levi M. Stanley

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Cyclopentadienyl-bis(oxazoline) Magnesium and Zirconium Complexes in Aminoalkene Hydroaminations, Naresh Eedugurala, Megan Hovey, Hung-An Ho, Barun Jana, Nicole L. Lampland, Arkady Ellern, and Aaron D. Sadow