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RESEARCH PAPER · ACS Combinatorial Science · 2016

High Throughput Light Absorber Discovery, Part 1: An Algorithm for Automated Tauc Analysis

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High Throughput Light Absorber Discovery, Part 1: An Algorithm for Automated Tauc AnalysisOriginalAutomated Phase Mapping with AgileFD and its Application to Light Absorber Discovery in the V–Mn–Nb Oxide System80The dawn of unmanned analytical laboratories94Recent developments in complex metal oxide photoelectrodes165Combinatorial Discovery of Lanthanum–Tantalum Oxynitride Solar Light Absorbers with Dilute Nitrogen for Solar Fuel Applications17Automated algorithms for band gap analysis from optical absorption spectra28Combinatorial alloying improves bismuth vanadate photoanodes via reduced monoclinic distortion23Fabrication of core@interface:shell structured CuS@CuInS 2 :In 2 S 3 particles for highly efficient solar hydrogen production33Electrochromic effect in Q-carbon15High Throughput Experimentation for the Discovery of Water Splitting Materials4Kramers–Kronig calculations for linear and nonlinear optics of nanostructured methyl violet (CI-42535): New trend in laser power attenuation using dyes25Machine learning of optical properties of materials – predicting spectra from images and images from spectra131Inverse logarithmic derivative method for determining the energy gap and the type of electron transitions as an alternative to the Tauc method96Visible‐Light‐Driven Water Oxidation with a Polyoxometalate‐Complexed Hematite Core of 275 Iron Atoms64Visible‐Light‐Driven Water Oxidation with a Polyoxometalate‐Complexed Hematite Core of 275 Iron Atoms14Facile and green synthesis of copper nanoparticles loaded on the amorphous carbon nitride for the oxidation of cyclohexane98Synthesis, optical imaging, and absorption spectroscopy data for 179072 metal oxides22Automated method for the determination of the band gap energy of pure and mixed powder samples using diffuse reflectance spectroscopy250Reactor based XPS and other in-situ studies on the Effect of Substitution of Bismuth for Indium in Defect Laden Indium Oxide Hydroxide BizIn2-zO3-x(OH)y on the Photocatalytic Hydrogenation of Carbon Dioxide2Universal Work Function of Metal Oxides Exposed to Air46Kinetically Stable Single Crystals of Perovskite-Phase CsPbI3238Nonlinear optical characterization of copper oxide nanoellipsoids90Single variable defined technology control of the optical properties in MoS 2 films with controlled number of 2D-layers12Titanate-based one-dimensional nano-heterostructure: Study of hydrothermal reaction parameters for improved photocatalytic application20Dual photoluminescent blue and green emission bands by the enantiopure (S)-(+)-1-(4-bromophenyl)-N-1-phenylethylmethanimine crystals3Synergistic Coupling of Photo and Thermal Conditions for Enhancing CO2 Reduction Rates in the Reverse Water Gas Shift Reaction18A study of the optical band gap energy and Urbach energy of fullerene (C60) doped PMMA nanocomposites31Aqueous electrosynthesis of silver indium selenide nanocrystals and their photothermal properties16Dye degradation performance, bactericidal behavior and molecular docking analysis of Cu-doped TiO 2 nanoparticles172Enhancement of Structural, Optical and Electrical Properties of Manganese Doped Stannic Oxide Nanoparticles4Photocatalytic and bactericidal properties and molecular docking analysis of TiO 2 nanoparticles conjugated with Zr for environmental remediation105Tailoring of the Structural and Optoelectronic Properties of Zinc-Tin-Oxide Thin Films via Oxygenation Process for Solar Cell Application25Synthesis, crystal structure and optical properties of Anderson-type heteropolyanion with cobalt cations7Tunable emission of AgIn5S8 and ZnAgIn5S8 nanocrystals: electrosynthesis, characterization and optical application19Graphene oxide discarded solution for high surface area photocatalyst11Visible light active ZnO nanostructures prepared by simple co-precipitation method39Enhanced Visible Light Photocatalytic Activity of N and Ag Doped and Co-Doped TiO2 Synthesized by Using an In-Situ Solvothermal Method for Gas Phase Ammonia Removal85Cerium-Oxide-Nanoparticle-Decorated Zinc Oxide with Enhanced Photocatalytic Degradation of Methyl Orange83Perovskite-like Framework Encapsulated with Fe-Based Magnetic Units in Ba10Fe3Sb7Se245Enhanced Photosensitization by Carbon Dots Co-adsorbing with Dye on p‑Type Semiconductor (Nickel Oxide) Solar Cells69Enhanced photoluminescence in CaMoO4:Eu3+ by Mn2+ co-doping49A comprehensive study on the enhanced photocatlytic activity of a double-shell mesoporous plasmonic Cu@Cu2O/SiO2 as a visible-light driven nanophotocatalyst42Synthesis of holmium oxide (Ho2O3) nanocrystal by chemical bath deposition222D chemically exfoliated hexagonal boron nitride (hBN) nanosheets doped with Ni: synthesis, properties and catalytic application for the treatment of industrial wastewater102Structural and magnetic properties of titanate nano-heterostructures decorated with iron based nanoparticles15Evaluation of antibacterial and catalytic potential of copper-doped chemically exfoliated boron nitride nanosheets69Solid state organic photovoltaic devices using spirulina sp thylakoid membrane films as active material1Strategy for Modifying Layered Perovskites toward Efficient Solar Light-Driven Photocatalysts for Removal of Chlorinated Pollutants14A comparative study of dirac 2D materials, TMDCs and 2D insulators with regard to their structures and photocatalytic/sonophotocatalytic behavior74Natural dyes in hybrid chalcogenide multi-layer thin films2Investigation of structural, optical and photoluminescence properties of nanostructured BaxSn1-xO2 thin films: An effect of Ba doping4Efficient Visible-Light Photocatalytic Cycloaddition of CO2 and Propylene Oxide Using Reduced Graphene Oxide Supported BiNbO464Fabrication of Zinc-Iron-Aluminum Layered Double Hydroxides with Controlled Micromorphology in a Tailored Aqueous - Organic Synthesis Medium1Community Discovery Algorithm and Its Technical Improvement Based on Link Structure–Taking Web Community Algorithm as an Example0Synthesis of Interface-Driven Tunable Bandgap Metal Oxides23Development of an algorithm for precise and automated determination of optical band gap from Tauc analysis: case studies using alpha-irradiated CR-39 detectors18Synthesis of CuInS2 and CuInS2@ZnX (X = S, Se) nanoparticles for bioimaging of cancer cells using electrochemically generated S2- and Se2-29Atomic Layer Deposition of PbS Thin Films at Low Temperatures37Quaternary Oxide Photoanode Discovery Improves the Spectral Response and Photovoltage of Copper Vanadates21Bi Alloying into Rare Earth Double Perovskites Enhances Synthesizability and Visible Light Absorption9Zn/La Mixed Oxides Prepared by Coprecipitation: Synthesis, Characterization and Photocatalytic Studies18A novel double Ag@AgCl/Cu@Cu2O plasmonic nanostructure: Experimental design and LC-Mass detection of tetracycline degradation intermediates77High-Throughput Characterization of (Fe x Co 1– x ) 3 O 4 Thin-Film Composition Spreads12Synthesis and characterization of tetragonal and orthorhombic Sn1-xBaxO2 nanostructures via the spray pyrolysis method15Optical and structural characterization of Tm2O3, TmN, and TmOxNy thin films grown by direct-current reactive magnetron sputtering11TiO2 Doped with Noble Metals as an Efficient Solution for the Photodegradation of Hazardous Organic Water Pollutants at Ambient Conditions96Dipole relaxation process and giant dielectric permittivity in Eu3+-doped CdMoO4 single crystal6Copper oxide integrated perylene diimide self-assembled graphitic pencil for robust non-enzymatic dopamine detection23Designing New Atomic Layer Deposition Precursors for Third-Generation Photovoltaics0Green synthesis of gold nanoparticles using an antiepileptic plant extract: in vitro biological and photo-catalytic activities148Incommensurate transition-metal dichalcogenides via mechanochemical reshuffling of binary precursors7A Generalized Semiempirical Approach to the Modeling of the Optical Band Gap of Ternary Al-(Ga, Nb, Ta, W) Oxides Containing Different Alumina Polymorphs6Fabrication of MIL-53(Al)/Ag/AgCl plasmonic nanocomposite: An improved metal organic framework based photocatalyst for degradation of some organic pollutants57Exploring the optical and dielectric properties of bifunctional and trifunctional epoxy polymers17Materials Representation and Transfer Learning for Multi-Property Prediction4Materials Representation and Transfer Learning for Multi-Property Prediction1Materials representation and transfer learning for multi-property prediction71Perylene diimide/MXene-modified graphitic pencil electrode-based electrochemical sensor for dopamine detection81Catalytic and photocatalytic activity of Urtica dioica-mediated Ud-ZnO nanoparticles8Geometric structure distribution and oxidation state demand of cations in spinel NixFe1-xCo2O4 composite cathodes for solid oxide fuel cells69Solution-State Catalysis of Visible Light-Driven Water Oxidation by Macroanion-Like Inorganic Complexes of γ-FeOOH Nanocrystals34Accurate band gap determination of chemically synthesized cobalt ferrite nanoparticles using diffuse reflectance spectroscopy71Green synthesis and characterization of Fe doped ZnO nanoparticles and their interaction with bovine serum albumin11High-quality and single-crystal ZnSnO3 thin films: Fabrication and properties10Facile Modification of Tio2 Nanoparticles with H2o2 + Nh4f for Enhanced Visible Light Photodegradation of Rhodamine B and Methylene Blue13Preparation of boron doped diamond-like carbon films in a low-pressure high-density plasma in RF ICP-CVD3Pressure-induced phase transitions and electronic properties of Cd 2 V 2 O 75Giant Third-Order Nonlinear Response of Mixed Perovskite Nanocrystals19Visible-Light-Driven Reduced Graphite Oxide as a Metal-Free Catalyst for Degradation of Colored Wastewater7Analysis of the thermal stability and optical properties of KBiFe 2 O 5 perovskite obtained by a polymeric precursor method1Effect of Excess B in Ni2P-Coated Boron Nitride on the Photocatalytic Hydrogen Evolution from Water Splitting26Agents for sequential learning using multiple-fidelity data38A facile method for Tauc exponent and corresponding electronic transitions determination in semiconductors directly from UV–Vis spectroscopy data492Growth of diamond-like carbon films with significant nanocrystalline phases in a low-pressure high-density CH4 plasma in ICP-CVD: Effect of negative dc substrate bias13Titania Derived from NH2-MIL-125(Ti) Metal–Organic Framework for Selective Photocatalytic Conversion of CO2 to Propylene Carbonate15Cyclic carbonate formation from cycloaddition of CO2 to epoxides over bismuth subgallate photocatalyst17Extended dose response of 10B+CR-39 for thermal neutrons using spectrophotometric techniques5Photocatalytic activity of ZnO-PbS nanoscale toward Allura Red AC in an aqueous solution: Characterization and mechanism study25Synthesis of High Quality Transparent Nanocrystalline Diamond Films on Glass Substrates Using a Distributed Antenna Array Microwave System13Surveying Metal Antimonate Photoanodes for Solar Fuel Generation8Cerium oxide: synthesis, brief characterization, and optimization of the photocatalytic activity against phenazopyridine in an aqueous solution13A mechanistic study of the photocatalytic activity of AgI–WO 3 in an experimentally designed approach toward methylene blue photodegradation11Fe Substitutions Improve Spectral Response of Bi2WO6-Based Photoanodes14A magnetically separable clinoptilolite supported CdS-PbS photocatalyst: Characterization and photocatalytic activity toward cefotaxime114Synthesis and characterization of nano crystallite plaster of Paris prepared from waste eggshells and exploration of cytotoxicity, hemolysis and antimicrobial properties24Synthesis and characterization of nano-crystallite triple superphosphate from waste Pila globosa shells for sustainable industrial production5Synthesis and photothermal performance of non-stoichiometric molybdenum oxide (MoO 3− x ) prepared by gamma radiation4Synthesis-Crystal Structure, Spectroscopic, Dft-D3 Study, Electronic Proprieties, and Hs/2d Iso-Surface of (Nh4)4[Mo8o26].4h2o0Ba3.5Cu7.55In1.15Se9: A Wide-Bandgap Copper Indium Selenide Reveals Strong Luminescence and Third-Harmonic Generation1Synthesis of Bi2O3 NPs with polyethylene glycol and investigation of photodegradation of phenazopyridine in aqueous solution20Tuning electronic and magnetic properties through disorder in V2O5 nanoparticles34THE EFFECT OF HYDROTHERMAL TEMPERATURE AND TIME OF UREA-DOPING ON THE OPTICAL PROPERTIES OF LEMONGRASS-BASED CARBON DOTS0Combinatorial Sputter Synthesis of Single‐Phase La(XYZ)O3 ± σ Perovskite Thin‐Film Libraries: A New Platform for Materials Discovery3Boosted photocatalytic conversion of CO2 into solar fuel through photo-magnetic coupling2Evaluation of the photodegradation activity of bismuth oxoiodide/bismuth sub-carbonate nanocatalyst: Experimental design and the mechanism study41Idealizing Tauc Plot for Accurate Bandgap Determination of Semiconductor with Ultraviolet–Visible Spectroscopy: A Case Study for Cubic Boron Arsenide149Deposition of TiOx and N-TiOx by dielectric barrier discharge at atmospheric pressure4Investigation on ammonia-free scalable cobalt-doped hexagonal boron nitride for environmental remediation1A co-precipitation synthesized BiOI/(BiO)2CO3 nanocatalyst: An experimental design and mechanism study towards photodegradation of sulfasalazine16Thermal atomic layer deposition of ternary Ge-S-Se alloy for advanced ovonic threshold switch selectors in three-dimensional cross-point memory array7Electrosynthesis and characterization of alloyed CdSxSe1−x ternary quantum dots9ZnSb Films on Flexible Substrates: Stability, Optical Bandgap, Electrical Properties, and Indium Doping3In-situ construction of Bi2S3/BiOI heterojunctions with boosted photocatalytic activity2CaTiO3 perovskite /g-C3N4 heterojunction-based composite photocatalyst, part II: Synthesis, characterization and the boosted photocatalytic activity towards Gemifloxacin34Construction of Al2o3/Biocl S-Scheme Heterojunction Nanosheets for Enhanced Photocatalytic Degradation of Organic Dyes0High-throughput screening and characterization of novel zeolitic imidazolate framework gels4Comment about the use of unconventional Tauc plots for bandgap energy determination of semiconductors using UV–Vis spectroscopy102Synergistic photocatalytic effect of α-Fe2O3-ZnO binary nanocatalyst toward methylene blue: An experimental design study9Concepts behind the Redox Photocatalysis with Quantum Dots10Exploring secondary optical transitions: a study utilizing the DITM method, and enhanced photocatalytic properties in Ni-doped CuSe14Study of the mechanism pathway of sulfasalazine degradation on a novel quadripartite visible-light-driven photocatalyst0Growth of boron-doped diamond-like carbon films from a low-pressure high-density plasma in inductively coupled chemical vapour deposition6The coupled WO3-AgBr nanocatalyst, part II: Synthesis, characterization, and the boosted photocatalytic activity towards metronidazole in an aqueous solution18Negative dc substrate bias influencing the low-temperature growth of B-doped DLCs in a low-pressure rf inductive plasma7Characterization of NiCuOxNy Coatings Obtained via RF Sputtering: Structure, Morphology, and Optical Properties2Face-centered cubic carbon as a fourth basic carbon allotrope with properties of intrinsic semiconductors and ultra-wide bandgap8Incorporation of TiO2 and TiO2-Ag Nanoparticles in Recycled High-Density Polyethylene: Effect of the Type of Photocatalyst and Incorporation Method on Photocatalytic Activity for the Decomposition of NO4Maximizing Potential Applications of MAX Phases: Sustainable Synthesis of Multielement Ti 3 AlC 215Synthesis of amorphous CoSn(OH)6 nanocubes for photocatalytic reduction of 4-nitrophenol4Fabrication of ZnCo2O4-Zn(OH)2 Microspheres on Carbon Cloth for Photocatalytic Decomposition of Tetracycline10Zeolitic imidazolate framework-67/barium zirconate titanate nanocomposite, Part I: Synthesis, characterization, and boosted photocatalytic activity26Automatic microextraction methods for forensic drugs analysis: principles, recent trends, challenges, and applications2Thermodynamic optoelectronic and photovoltaic properties of Al-doped boron arsenide alloy6A photodegradation study of the deposition fabricated CdS–BiVO 4 binary catalyst: a brief comparison with other fabrication procedures5An outstanding, efficient visible-light-driven BiOI/LaCoO 3 Z-scheme system toward cefixime degradation7Indium-doped zinc sulfide nanopowders for boosting photocatalytic stream water splitting20Nitrogen-doped carbon dots/indium-doped zinc sulfide heterostructures for enhanced photocatalytic seawater splitting6Co-precipitation synthesis and characterization of Zn(II)/Ni(II) magnetic heterostructure ferrite for photocatalytic degradation of metronidazole21Construction of novel N-doped CDs@CdS@ZnS composite via interfacial charge transfer effect for highly improved photocatalytic seawater splitting14A study on the boosted activity of the Bi2O3CeO2 nanoparticles toward phenazopyridine photodegradation; A brief comparison of the effects of some coupling strategies6Construction of Al 2 O 3 /BiOCl S-scheme heterojunction nanosheets for enhanced photocatalytic degradation of organic dyes1

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