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Submissions from 2013

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Kinetic and Dynamic Studies of the Cl(²Pu) + H ₂O(X¹A₁) → HCl(X¹Σ⁺) + OH(X²Π) Reaction on an Ab Initio Based Full-dimensional Global Potential Energy Surface of the Ground Electronic State of ClH₂O, Jun Li, Richard Dawes, and Hua Guo

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Dispersion Force Stabilized Two-coordinate Transition Metal-Amido Complexes of the -N(SiMe₃)Dipp (Dipp = C₆H₃-2,6-Pri₂) Ligand: Structural, Spectroscopic, Magnetic, and Computational Studies, Chun-Yi Lin, Jingdong Guo, James C. Fettinger, Shigeru Nagase, Fernande Grandjean, Gary J. Long, Nicholas F. Chilton, and Philip P. Power

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Preparation of Uncapped CdSeₓTe₁-ₓ Nanocrystals with Strong Near-IR Tunable Absorption, Shaohua Li, Guolong Tan, James B. Murowchick, Clarissa Wisner, Nicholas Leventis, Ting Xia, Xiaobo Chen, and Zhonghua Peng

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Synthesis, Characterization and Applications of Carboxylated and Polyethylene-glycolated Bifunctionalized InP/ZnS Quantum Dots in Cellular Internalization Mediated by Cell-penetrating Peptides, Bettyrevon Liu, Jeffrey G. Winiarz, Jong-Sik Moon, Shih-Yen Lo, Yue-Wern Huang, Robert Aronstam, and Hanjung Lee

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Understanding the Response of Nanostructured Polyaniline Gas Sensors, Zhe-Fei Li, Frank D. Blum, Massimo F. Bertino, and Chang-Soo Kim

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Effects of N-acetylcysteine Amide (NACA) Eye Drops on Acetaminophen-Induced Cataracts in C57BL/6 Mice, Krishna Yasaswi Maddirala, Shakila Tobwala, and Nuran Ercal

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Ionic Liquid Electrolytes For Lithium Batteries: Synthesis, Electrochemical, and Cytotoxicity Studies, Ninu Madria, T. A. Arunkumar, Nanditha G. Nair, Avinash Vadapalli, Yue-wern Huang, Simon C. Jones, and Prakash Reddy

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Automatic Pill Identification from Pillbox Images, David E. Madsen, Katie S. Payne, Jason R. Hagerty, Nathan Szanto, Mark Wronkiewiecz, Randy Hays Moss, and William V. Stoecker

Polybenzoxazine Aerogels: Synthesis, Characterization, and Conversion to Carbon and Graphite Aerogels, Shruti Mahadik-Khanolkar, Clarissa A. Wisner, Gitogo Churu, Hongbing Lu, Nicholas Leventis, and Chariklia Sotiriou-Leventis

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Intercalation and Delamination of Layered Carbides and Carbonitrides, Olha Mashtalir, Michael Naguib, Vadym Mochalin, Yohan Dall'Agnese, Min Heon, Michel W. Barsoum, and Yury G. Gogotsi

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Pteridine Detection in Urine: The Future of Cancer Diagnostics?, Yinfa Ma and Casey Burton

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Elevated-Temperature Vacuum-Assisted Resin Transfer Molding Process for High Performance Aerospace Composites, V. G. K. Menta, Rama Bhadra Raju Vuppalapati, K. Chandrashekhara, Thomas P. Schuman, and Jilun Sha

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Growth of Vertically Aligned CdTe Nanorod Arrays through Patterned Electrodeposition, Sukhada Mishra and Manashi Nath

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Synthesis of Superconducting Nanocables of FeSe Encapsulated in Carbonaceous Shell, Sukhada Mishra, Kai Song, Jakub A. Koza, and Manashi Nath

Synthesis of Magnetic Multifunctional Au-CoSe Nanoparticles through Chemical Vapor Deposition, Sukhada Mishra, Kai Song, and Manashi Nath

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Aziridine Cure of Acrylic Colloidal Unimolecular Polymers (CUPs), Jigar K. Mistry and Michael R. Van-De-Mark

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Adsorption of Drugs on Nanodiamond: Toward Development of a Drug Delivery Platform, Vadym Mochalin, Amanda E. Pentecost, Xuemei Li, Ioannis Neitzel, Chongyang Wei, Tao He, Fang Guo, and Yury G. Gogotsi

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Polydicyclopentadiene Aerogels Grafted with PMMA: II. Nanoscopic Characterization and Origin of Macroscopic Deformation, Dhairyashil Mohite, S. Mahadik-Khanolkar, H. Luo, Hongbing Lu, Chariklia Sotiriou-Leventis, and Nicholas Leventis

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Polydicyclopentadiene Aerogels Grafted with PMMA: I. Molecular and Interparticle Crosslinking, Dhairyashil Mohite, S. Mahadik-Khanolkar, H. Luo, Hongbing Lu, Chariklia Sotiriou-Leventis, and Nicholas Leventis

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Mononuclear and Binuclear Cu(II) Complexes of Some Tridentate Aroyl Hydrazones. X-ray Crystal Structures of a Mononuclear and a Binuclear Complex, Satyajit Mondal, Sumita Naskar, Ayan Kumar Dey, Ekkehard Sinn, Carla S. Eribal, Steven R. Herron, and Shyamal Kumar Chattopadhyay

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1,3-Sigmatropic Fluorine Migration to Boron in McLafferty Type of Rearrangements: Observation of Tetrafluorobenzyne Radical Cation and Trifluorobenzyne Cation by CID-Mass Spectrometry, Nanditha G. Nair, Jose L. Mendoza-Cortes, Ravinder Abrol, William A. Goddard III, and Prakash Reddy

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Novel Fully Screen Printed Flexible Electrochemical Sensor For the Investigation of Electron Transfer between Thiol Functionalized Viologen and Gold Clusters, Binu Baby Narakathu, Mary Sajini Devadas, Avuthu Sai Guruva Reddy, Ali Eshkeiti, Akhil Moorthi, Isurika R. Fernando, Bazsa P. Miller, Guda Ramakrishna, Ekkehard Sinn, Margaret Joyce, Marian Rebros, Erika Rebrosova, Gellert Mezei, and Massood Zandi Atashbar

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Accurate Determination of Barrier Height and Kinetics for the F + H 2O → HF + OH Reaction, Thanh Lam Am Nguyen, Jun Li, Richard Dawes, John F. Stanton, and Hua Guo

Utilization of Flue Gas as a Carbon Dioxide Source from a Coal-Burning Power Plant for the Cultivation of Microalgae in Outdoor Circular Ponds, Swaminathan Palanisami, Thiruvenkadam Viswanathan, Nicholas Dudenhoeffer, Keesoo Lee, and Paul Ki-souk Nam

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Nanodiamond Graphitization: A Magnetic Resonance Study, Alexander M. Panich, Alexander I. Shames, Nikolaj A. Sergeev, Marcin Olszewski, John K. McDonough, Vadym Mochalin, and Yury G. Gogotsi

Trap Design for the Brown Recluse Spider, Loxosceles Reclusa, Jennifer Parks, William V. Stoecker, and Robert L. Paige

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Posterolateral Neck Texture (Insulin Neck): Early Sign of Insulin Resistance, Katie S. Payne, Ryan K. Rader, Guido Lastra, and William V. Stoecker

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Directed Assembly of One-Dimensional Functional Nanostructures, Erika Penzo, Matteo Palma, Risheng Wang, and Shalom J. Wind

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A Classical Trajectory Study of the Intramolecular Dynamics, Isomerization, and Unimolecular Dissociation of HO₂, Jamin W. Perry, Richard Dawes, Albert F. Wagner, and Donald L. Thompson

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Erratum: A Classical Trajectory Study of the Intramolecular Dynamics, Isomerization, and Unimolecular Dissociation of HO₂ [J. Chem. Phys. 139, 084319 (2013)], Jamin W. Perry, Richard Dawes, Albert F. Wagner, and Donald L. Thompson

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Surface Temperature Effects on the Dynamics of N₂ Eley-Rideal Recombination on W(100), Ernesto Quintas-Sánchez, C. Crespos, P. Larrégaray, J. C. Rayez, L. Martin-Gondre, and J. Rubayo-Soneira

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CD30⁺ Reversible Lymphoid Dyscrasia (Pseudolymphoma) Following HIDA Scintigraphy and the [Ring1]-[Ring2]-[C=O] Generalized Structure Hypothesis, Ryan K. Rader, William V. Stoecker, Kristen A. Hinton, Janine C. Malone, and Thomas P. Schuman

Synthesis and Use of Epoxy Phosphonate Ester as a Coupling Agent for Metal Oxide Interfaces, R. A. A. Upul Ranaweera, Nicholas Jentsch, and Thomas P. Schuman

Asymmetric Synthesis of the 3-TOSU Monomer, R. A. A. Upul Ranaweera, S. Subramani, Nicholas Jentsch, and Thomas P. Schuman

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Friedel-Crafts Reactions, Prakash Reddy and Gubbi Krishnamurthy Prakash

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N-Heterocyclic Carbenes in Organofluorine Chemistry, Prakash Reddy, Avinash Vadapalli, Ekkehard Sinn, and Narayan Hosmane

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C4a-hydroperoxyflavin Formation in N -hydroxylating Flavin Monooxygenases is Mediated by the 2′-OH of the Nicotinamide Ribose of NADP⁺, Reeder Robinson, Somayesadat Badieyan, and Pablo Sobrado

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Flavin-dependent Monooxygenases in Siderophore Biosynthesis, Reeder M. Robinson and Pablo Sobrado

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In Vivo Ultrasonic Detection of Polyurea Crosslinked Silica Aerogel Implants, Firouzeh Sabri, Merry E. Sebelik, Ryan K. Meacham, John Dudley Boughter, Mitchell J. Challis, and Nicholas Leventis

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Redox Reactions in Prussian Blue Containing Paint Layers as a Result of Light Exposure, Louise Samain, Bernard P. Gilbert, Fernande Grandjean, Gary J. Long, and David Strivay

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Synthesis and Fading of Eighteenth-century Prussian Blue Pigments: A Combined Study by Spectroscopic and Diffractive Techniques Using Laboratory and Synchrotron Radiation Sources, Louise Samain, Fernande Grandjean, Gary J. Long, Pauline Martinetto, Pierre Bordet, Jana Sanyova, and David Strivay

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Relationship Between the Synthesis of Prussian Blue Pigments, Their Color, Physical Properties, and Their Behavior in Paint Layers, Louise Samain, Fernande Grandjean, Gary J. Long, Pauline Martinetto, Pierre Bordet, and David Strivay

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Mixed-ligand Nickel(II) Thiosemicarbazone Complexes: Synthesis, Characterization and Biological Evaluation, Saswati, Rupam Dinda, Carla S. Schmiesing, Ekkehard Sinn, Yogesh P. Patil, Munirathinam Nethaji, Helen Stoeckli-Evans, and Rama Acharyya

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Pharmacological Inhibition Of Mitochondrial Carbonic Anhydrases Protects Mouse Cerebral Pericytes From High Glucose-induced Oxidative Stress And Apoptosis, Gul N. Shah, Tulin O. Price, William A. Banks, Yoichi Morofuji, Andrej Kovac, Nuran Ercal, Christine M. Sorenson, Eui S. Shin, and Nader Sheibani

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Formation of Haloacetic Acids, Halonitromethanes, Bromate and Iodate During Chlorination and Ozonation of Seawater and Saltwater of Marine Aquaria Systems, Honglan Shi, Zhimin Qiang, and Craig D. Adams

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Role of Ser-257 in the Sliding Mechanism of NADP(H) in the Reaction Catalyzed by the Aspergillus Fumigatus Flavin-dependent Ornithine N ⁵-monooxygenase SidA, Carolyn Shirey, Somayesadat Badieyan, and Pablo Sobrado

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Dielectric Properties of Polymer-particle Nanocomposites Influenced by Electronic Nature of Filler Surfaces, Sasidhar Siddabattuni, Thomas P. Schuman, and Fatih Dogan

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Impedance Analysis of Dielectric Nanoparticles Enabled via a Self-assembled Monolayer, Sasidhar Siddabattuni, Thomas P. Schuman, Vladimir Petrovsky, and Fatih Dogan

Designing Protocols for Synthesis of Superconduting LiFeAs Nanostructures through Sacrificial Template Method, Prachi Sood and Manashi Nath

Automatic Detection of Skin Cancer: Current Status, Path for the Future, William V. Stoecker, Nabin K. Mishra, Robert W. LeAnder, Ryan K.Ent Rader, and R. Joe Stanley

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Template Matching for Detection of Starry Milia-Like Cysts in Dermoscopic Images, Viswanaath Subramanian, Randy Hays Moss, Ryan K. Rader, Sneha K. Mahajan, and William V. Stoecker

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The Flow Behavior of Friction Reducer in Microchannels during Slickwater Fracturing, Yongpeng Sun, Qihua Wu, Baojun Bai, and Yinfa Ma

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Experimental Study of Friction Reducer Flows in Microfracture during Slickwater Fracturing, Yongpeng Sun, Hao Zhang, Qihua Wu, Mingzhen Wei, Baojun Bai, and Yinfa Ma

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Breaking Aggregation and Driving the Keto-to-gem-Diol Equilibrium of the N,N'-Dimethyl-2,6-diaza-9,10-anthraquinonediium Dication to the Keto Form by Intercalation in Cucurbit[7]uril, Arumugam Thangavel, Ian A. Elder, Chariklia Sotiriou-Leventis, Richard Dawes, and Nicholas Leventis

N-acetylcysteine Amide (NACA), a Novel GSH Prodrug: Its Metabolism and Implications in Health, Shakila Tobwala and Nuran Ercal

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N-acetylcysteine Amide, a Thiol Antioxidant, Prevents Bleomycin-induced Toxicity in Human Alveolar Basal Epithelial Cells (A549), Shakila Tobwala, Weili Fan, Tobias Stoeger, and Nuran Ercal

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Effects of a Novel Thiol Antioxidant, N-Acetylcysteine Amide (NACA), on Reversing Sodium Selenite-Induced Cataracts in Wistar Rats, Shakila Tobwala, Sri Krishna Maddirala, and Nuran Ercal

Surface Tension of Colloidal Unimolecular Polymer Particles at Air/Water Interface, Michael R. Van-De-Mark, Minghang Chen, and Spencer G. Norman

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Manufacturing and Impact Characterization of Soy-Based Polyurethane Pultruded Composites, Rama Bhadra Raju Vuppalapati, V. G. K. Menta, K. Chandrashekhara, and Thomas P. Schuman

Influence of Potential Energy Surfaces on the Reaction Dynamics of Small Molecules, Albert Wagner, Richard Dawes, Hua Guo, and Donald Thompson

Preface (Editorial), Adam K. Wanekaya, Charles C. Chusuei, Y. Lei, and Y. T. Hung

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Investigation of Removal of N-nitrosamines and their Precursors in Water Treatments using Activated Carbon Nanoparticles, Chuan Wang, Honglan Shi, Craig D. Adams, Terry Timmons, and Yinfa Ma

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N-acetylcysteine amide (NACA) Prevents Retinal Degeneration Induced by Sodium Iodate in C57BL/6 Mice, Hsiu-Jen Wang, Shakila B. Tobwala, Deniel Lindgren, Robert Aronstam, Humeyra Karacal, and Nuran Ercal

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Lithographically Directed Assembly of One-Dimensional DNA Nanostructures via Bivalent Binding Interactions, Risheng Wang, Matteo Palma, Erika Penzo, and Shalom J. Wind

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Morphology of Hydrothermally Synthesized ZnO Nanoparticles Tethered to Carbon Nanotubes Affects Electrocatalytic Activity For H₂O₂ Detection, Mulugeta B. Wayu, Ryan T. Spidle, Tuphan Devkota, Anup K. Deb, Robert K. Delong, Kartik C. Ghosh, Adam K. Wanekaya, and Charles C. Chusuei

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Correlation of Microstructure and Thermal Conductivity in Nanoporous Solids: The Case of Polyurea Aerogels Synthesized From an Aliphatic Tri-isocyanate and Water, L. Weigold, Dhairyashil Mohite, S. Mahadik-Khanolkar, Nicholas Leventis, and G. Reichenauer

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Trace Metals in Fugitive Dust from Unsurfaced Roads in the Viburnum Trend Resource Mining District of Missouri--Implementation of a Direct-Suspension Sampling Methodology, Emitt C. Witt, David J. Wronkiewicz, Robert T. Pavlowsky, and Honglan Shi

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Charge Transfer and Blue Shifting of Vibrational Frequencies in a Hydrogen Bond Acceptor, Ashley M. Wright, Austin A. Howard, J. Coleman Howard, Gregory S. Tschumper, and Nathan I. Hammer

Computational Hierarchical Nanomechanics of Self-Assembled Polyurea Aerogels, Chenglin Wu, Shruti Mahadik-Khanolkar, Genda Chen, and Nicholas Leventis

Computational Hierarchical Nanomechanics of Self-assembled Polyurea Aerogels, C. Wu, S. Mahadik-Khanolkar, G. Chen, and Nicholas Leventis

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Optic Imaging of Two-Phase Flow Behavior in Nano-Scale Fractures, Qihua Wu, Baojun Bai, Yinfa Ma, Jeongtae Ok, Keith B. Neeves, and Xiaolong Yin

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Optic Imaging of Single and Two-Phase Pressure-Driven Flows in Nano-Scale Channels, Qihua Wu, Jeong Tae Ok, Yongpeng Sun, S. T. Retterer, Keith B. Neeves, Xiaolong Yin, Baojun Bai, and Yinfa Ma

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The Carriers of the Interstellar Unidentified Infrared Emission Features: Constraints from the Interstellar C-H Stretching Features at 3.2-3.5 µm, Xuejuan Yang, Rainer Glaser, Aigen Li, and Jianxin Zhong

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Luminescent LaF₃:Ce-doped Organically Modified Nanoporous Silica Xerogels, Mingzhen Yao, Ryan Hall, Wei Chen, Dhairyashil Mohite, Nicholas Leventis, N. Lu, J. Wang, M. J. Kim, H. Luo, and Hongbing Lu

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Site-Specific Inter-Strand Cross-Links of DNA Duplexes, Miao Ye, Johan Guillame, Yu Liu, Ruojie Sha, Risheng Wang, Nadrian C. Seeman, and James W. Canary

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Characterization of the Biocompatibility and Mechanical Properties of Polyurea Organic Aerogels with the Vascular System: Potential as a Blood Implantable Material, Wei Yin, Hongbing Lu, Nicholas Leventis, and David A. Rubenstein

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Magnetic Blocking in a Linear Iron(I) Complex, Joseph M. Zadrozny, Dianne J. Xiao, Mihail A. Atanasov, Gary J. Long, Fernande Grandjean, Frank Neese, and Jeffrey R. Long

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Mössbauer Spectroscopy As a Probe of Magnetization Dynamics in the Linear Iron(I) and Iron(II) Complexes [Fe(C(SiMe₃)₃)₂]1-/0, Joseph M. Zadrozny, Dianne J. Xiao, Jeffrey R. Long, Mihail A. Atanasov, Frank Neese, Fernande Grandjean, and Gary J. Long

Submissions from 2012

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Critical Role of Cytochrome P450 2E1 (CYP2E1) in the Development of High Fat-induced Non-alcoholic Steatohepatitis, M. A. Abdelmegeed, Atrayee Banerjee, S. H. Yoo, S. Jang, F. J. Gonzalez, and B. J. Song

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Orientation of Pyrylium Guests in Cucurbituril Hosts, Thangavel Arumagum, Chariklia Sotiriou-Leventis, Richard Dawes, and Nicholas Leventis

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Experimental and Theoretical Studies of the Electronic Transitions of BeC, Beau J. Barker, Ivan O. Antonov, Jeremy M. Merritt, Vladimir E. Bondybe, Michael C. Heaven, and Richard Dawes

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Magnetic Properties of Fe₂GeMo₃N; An Experimental and Computational Study, Peter D. Battle, Lev A. Sviridov, Russell J. Woolley, Fernande Grandjean, Gary J. Long, C. Richard Catlow, Alexey A. Sokol, Aron Walsh, and Scott M. Woodley

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Structural and Magnetic Studies of a Quasi-inverse Sandwich Cyclooctatetraene Complex with Two High-Spin Chromium(II) Ions Bound Anti-facially, Jessica N. Boynton, Owen T. Summerscales, Fernande Grandjean, Gary J. Long, James C. Fettinger, and Philip P. Power

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Computational Study of the Rovibrational Spectrum of (OCS)₂, James Corgan Brown, Xiao-Gang Wang, Richard Dawes, and Tucker Carrington Jr.

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A Novel Enzymatic Technique for Determination of Sarcosine in Urine Samples, C. Burton, Sanjeewa Gamagedara, and Yinfa Ma

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Basis Set Dependence of Higher-Order Correlation Effects in Π-Type Interactions, Emily J. Carrell, Cara M. Thorne, and Gregory S. Tschumper

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Comprehensive Screening Study of Pesticide Degradation via Oxidation and Hydrolysis, Evelyn F. Chamberlain, Honglan Shi, Tongwen Wang, Yinfa Ma, A. Fulmer, and Craig D. Adams

Mechanically Strong Nanoporous Polyimides (Aerogels) from Anhydrides and Isocyanates: A Structure-Property Study, Chakkaravarthy Chidambareswarapattar, Zachary J. Larimore, Chariklia Sotiriou-Leventis, and Nicholas Leventis

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From Flexible to Hard Polyurethane Aerogels: The Effect of Molecular Functionality vs. Molecular Rigidity, Chakkaravarthy Chidambareswarapattar, Jared M. Loebs, Zachary J. Larimore, Patrick M. McCarver, Autumn M. Kosbar, Lokeswarappa R. Dharani, Huiyang Luo, Hongbing Lu, Chariklia Sotiriou-Leventis, and Nicholas Leventis

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One Pot Synthesis of Multifunctional Aramid Aerogels, Chakkaravarthy Chidambareswarapattar, Dhairyashil Mohite, Zachary J. Larimore, Hongbing Lu, Chariklia Sotiriou-Leventis, and Nicholas Leventis

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Na₁.₅₁₅EuGeS₄, a Three-Dimensional Crystalline Assembly of Empty Nanotubules Constructed with Europium(II/III) Mixed Valence Ions, Amitava Choudhury, Fernande Grandjean, Gary J. Long, and Peter K. Dorhout

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Polycyclic Aromatic Hydrocarbon Emissions from the Combustion of Alternative Fuels in a Gas Turbine Engine, Simon Christie, David W. Raper, David S. Lee, Paul I. Williams, Lucas Rye, Simon Blakey, Chris W. Wilson, Prem Lobo, Donald E. Hagen, and Philip D. Whitefield

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Effects of Heterogeneity in Small Π-Type Dimers: Homogeneous and Mixed Dimers of Diacetylene and Cyanogen, Kari L. Copeland and Gregory S. Tschumper

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Hydrocarbon/water Interactions: Encouraging Energetics and Structures from DFT but Disconcerting Discrepancies for Hessian Indices, Kari L. Copeland and Gregory S. Tschumper

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Knowledge and Adherence to SEGO Recommendations for the Prevention of Cervical Cancer by Spanish Gynecologists in Daily Practice, Javier Cortés Bordoy, Jordi Xercavins, Rogelio Garrido, Pilar Miranda, José Manuel Ramón y Cajal, Julio Velasco, Demián Dexeus, Elena Álvarezy, Cristina Centeno, María Pilar Blasco Zapater, Margarita Burgues Olives, María Cáceres Sánchez, Alfonso de Castro Lezcano, and M. Pilar Del Río Castrillo

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Glutathione, Omca Demirkol and Nuran Ercal

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Crystal Structures and Small-angle X-ray Scattering Analysis of UDP-galactopyranose Mutase from the Pathogenic Fungus Aspergillus Fumigatus, Richa Dhatwalia, Harkewal Singh, Michelle Oppenheimer, Dale B. Karr, Jay C. Nix, Pablo Sobrado, and John J. Tanner

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Crystal Structures of Trypanosoma Cruzi UDP-galactopyranose Mutase Implicate Flexibility of the Histidine Loop in Enzyme Activation, Richa Dhatwalia, Harkewal Singh, Michelle Oppenheimer, Pablo Sobrado, and John J. Tanner

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Identification of the NAD(P)H Binding Site of Eukaryotic UDP-galactopyranose Mutase, Richa Dhatwalia, Harkewal Singh, Luis M. Solano, Michelle Oppenheimer, Reeder M. Robinson, Jacob F. Ellerbrock, Pablo Sobrado, and John J. Tanner

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N-acetyl-L-cysteine Amide Protects Retinal Pigment Epithelium Against Methamphetamine-induced Oxidative Stress, Nuran Ercal, Joshua W. Carey, Shakila Tobwala, Xinsheng Zhang, Atrayee Banerjee, Eylem Y. Pinarci, and Humeyra Karacal