Works matching Gas-Phase Models
Results: 718
Development of a mesoscale model for the gas phase fluid dynamics in structured packings based on fundamental experiments and CFD investigations.
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- Chemical Engineering Research & Design: Transactions of the Institution of Chemical Engineers Part A, 2019, v. 147, p. 430, doi. 10.1016/j.cherd.2019.04.032
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A Critical Remark on the Applications of Gas-Phase Biofilter (Packed-Bed Bioreactor) Models in Aqueous Systems.
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- Bioengineering (Basel), 2022, v. 9, n. 11, p. 657, doi. 10.3390/bioengineering9110657
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Double Bond Migration Mechanism in Allyl Systems Involving the Hydroxide Ion. 1. Gas-Phase and Born–Onsager Models.
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- Journal of Structural Chemistry, 2004, v. 45, n. 1, p. 12, doi. 10.1023/B:JORY.0000041496.30502.85
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基于超快速气相电子鼻及 Feller 加成模型的 胡椒精油特征香气成分分析.
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- China Food Additives, 2023, v. 34, n. 12, p. 238, doi. 10.19804/j.issn1006-2513.2023.12.031
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Construction and validation of a detailed gas-phase chemical reaction model for ammonium-dinitramide based ionic liquids.
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- Science & Technology of Energetic Materials, 2020, v. 81, n. 2, p. 53
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C versus O Protonation in Zincate Anions: A Simple Gas‐Phase Model for the Surprising Kinetic Stability of Organometallics.
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- Chemistry - A European Journal, 2023, v. 29, n. 22, p. 1, doi. 10.1002/chem.202203611
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Front Cover: Gas‐Phase Errors Affect DFT‐Based Electrocatalysis Models of Oxygen Reduction to Hydrogen Peroxide (ChemElectroChem 11/2022).
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- ChemElectroChem, 2022, v. 9, n. 12, p. 1, doi. 10.1002/celc.202200506
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Simulation of aromatic SOA formation using the lumping model integrated with explicit gas-phase kinetic mechanisms and aerosol-phase reactions.
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- Atmospheric Chemistry & Physics Discussions, 2013, v. 13, n. 3, p. 5843, doi. 10.5194/acpd-13-5843-2013
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Development and evaluation of the aerosol dynamic and gas phase chemistry model ADCHEM.
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- Atmospheric Chemistry & Physics Discussions, 2010, v. 10, n. 8, p. 18661, doi. 10.5194/acpd-10-18661-2010
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- Article
Simulation of aromatic SOA formation using the lumping model integrated with explicit gas-phase kinetic mechanisms and aerosol-phase reactions.
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- Atmospheric Chemistry & Physics, 2014, v. 14, n. 8, p. 4013, doi. 10.5194/acp-14-4013-2014
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Development and evaluation of the aerosol dynamics and gas phase chemistry model ADCHEM.
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- Atmospheric Chemistry & Physics, 2011, v. 11, n. 12, p. 5867, doi. 10.5194/acp-11-5867-2011
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Surface Model for Gas-Phase Polymerizations of Ethylene and Propylene Using Supported Metallocene/Methylalumoxane Catalysts.
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- Israel Journal of Chemistry, 2002, v. 42, n. 4, p. 367, doi. 10.1560/WGH0-XLDH-BNNE-EU6C
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Implementation and evaluation of online gas-phase chemistry within a regional climate model (RegCM-CHEM4).
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- Geoscientific Model Development Discussions, 2012, v. 5, n. 1, p. 149, doi. 10.5194/gmdd-5-149-2012
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A PERMEABILITY MODEL FOR WATER–GAS PHASE FLOW IN FRACTAL FRACTURE NETWORKS.
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- Fractals, 2018, v. 26, n. 6, p. N.PAG, doi. 10.1142/S0218348X18500871
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A Gas‐Phase Ca<sub>n</sub>Mn<sub>4−n</sub>O<sub>4</sub><sup>+</sup> Cluster Model for the Oxygen‐Evolving Complex of Photosystem II.
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- Angewandte Chemie, 2019, v. 131, n. 25, p. 8592, doi. 10.1002/ange.201903738
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Gas‐phase errors affect DFT‐based electrocatalysis models of oxygen reduction to hydrogen peroxide.
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- ChemElectroChem, 2022, v. 9, n. 12, p. 1, doi. 10.1002/celc.202200210
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- Article
Gas‐Phase Errors Affect DFT‐Based Electrocatalysis Models of Oxygen Reduction to Hydrogen Peroxide.
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- ChemElectroChem, 2022, v. 9, n. 12, p. 1, doi. 10.1002/celc.202200210
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- Article
Gas Phase Model Systems for Catalysis.
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- Zeitschrift für Physikalische Chemie, 2019, v. 233, n. 6, p. 755, doi. 10.1515/zpch-2019-1066
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New light on acetone: a master equation model for gas phase photophysics and photochemistry.
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- Molecular Physics, 2021, v. 119, n. 17/18, p. 1, doi. 10.1080/00268976.2021.1958018
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Tracking of the molecular geometrical changes in the primary event of photoinduced ring-opening reactions of a spiropyran model in gas phase.
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- Molecular Physics, 2021, v. 119, n. 4, p. 1, doi. 10.1080/00268976.2020.1814971
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Investigation into the Gaussian time-dependence of the rate coefficient in dispersive kinetic models applied to simple gas-phase chemical reactions.
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- Molecular Physics, 2014, v. 112, n. 1, p. 97, doi. 10.1080/00268976.2013.801528
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Modelling of soot formation in laminar diffusion flames using a comprehensive CFD-PBE model with detailed gas-phase chemistry.
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- Combustion Theory & Modelling, 2017, v. 21, n. 1, p. 35, doi. 10.1080/13647830.2016.1213426
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Using ellipsoids to model charge distributions in gas phase protein complex ion dissociation.
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- Canadian Journal of Chemistry, 2004, v. 82, n. 12, p. 1736, doi. 10.1139/V04-154
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Development and evaluation of the aerosol dynamic and gas phase chemistry model ADCHEM.
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- Atmospheric Chemistry & Physics Discussions, 2010, v. 10, n. 9, p. 18661, doi. 10.5194/acpd-10-18661-2010
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- Article
GEM-AQ, an on-line global multiscale chemical weather system: model description and evaluation of gas phase chemistry processes.
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- Atmospheric Chemistry & Physics Discussions, 2007, v. 7, n. 5, p. 14895, doi. 10.5194/acpd-7-14895-2007
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Predicting dermal absorption of gas-phase chemicals: transient model development, evaluation, and application.
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- Indoor Air, 2014, v. 24, n. 3, p. 292, doi. 10.1111/ina.12079
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Gas-Phase Mass Transfer Model for Predicting Volatile Organic Compound (VOC) Emission Rates from Indoor Pollutant Sources.
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- Indoor Air, 1996, v. 6, n. 1, p. 31, doi. 10.1111/j.1600-0668.1996.t01-3-00004.x
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Base‐Assisted Conversion of Protonated D‐Fructose to 5‐HMF: Searching for Gas‐Phase Green Models.
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- ChemistryOpen, 2019, v. 8, n. 9, p. 1190, doi. 10.1002/open.201900173
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Screening gas‐phase chemical kinetic models: Collision limit compliance and ultrafast timescales.
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- International Journal of Chemical Kinetics, 2020, v. 52, n. 9, p. 599, doi. 10.1002/kin.21373
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Impact of gas-phase mechanisms on Weather Research Forecasting Model with Chemistry (WRF/Chem) predictions: Mechanism implementation and comparative evaluation.
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- Journal of Geophysical Research. Atmospheres, 2012, v. 117, n. D1, p. n/a, doi. 10.1029/2011JD015775
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Interactions of Small Protected Peptides with Aminopyrazole Derivatives: The Efficiency of Blocking a β-Sheet Model in the Gas Phase.
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- Angewandte Chemie International Edition, 2009, v. 48, n. 5, p. 900, doi. 10.1002/anie.200802396
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Impact of urbanization on gas-phase pollutant concentrations: a regional-scale, model-based analysis of the contributing factors.
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- Atmospheric Chemistry & Physics, 2022, v. 22, n. 18, p. 12647, doi. 10.5194/acp-22-12647-2022
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Combining <sup>13</sup>C‐NMR Triad Sequence Data with Joint Molecular Weight and Composition Data to Estimate Parameters in a Gas‐Phase Polyethylene Reactor Model.
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- Macromolecular Theory & Simulations, 2023, v. 32, n. 3, p. 1, doi. 10.1002/mats.202200073
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Characterization of a pilot plant airlift tower loop reactor: III. Evaluation of local properties of the dispersed gas phase during yeast cultivation and in model media.
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- Biotechnology & Bioengineering, 1991, v. 38, n. 1, p. 56, doi. 10.1002/bit.260380108
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A Systematic Comparison of Detailed Soot Models and Gas-Phase Chemical Mechanisms in Laminar Premixed Flames.
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- Combustion Science & Technology, 2016, v. 188, n. 7, p. 1021, doi. 10.1080/00102202.2016.1145117
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Organic nitrate and secondary organic aerosol yield from NO<sub>3</sub> oxidation of β-pinene evaluated using a gas-phase kinetics/aerosol partitioning model.
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- Atmospheric Chemistry & Physics, 2009, v. 9, n. 4, p. 1431, doi. 10.5194/acp-9-1431-2009
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GEM-AQ, an on-line global multiscale chemical weather modelling system: model description and evaluation of gas phase chemistry processes.
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- Atmospheric Chemistry & Physics, 2008, v. 8, n. 12, p. 3255, doi. 10.5194/acp-8-3255-2008
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- Article
Air Gap Microcell for Scanning Electrochemical Microscopic Imaging of Carbon Dioxide Output. Model Calculation and Gas Phase SECM Measurements for Estimation of Carbon Dioxide Producing Activity of Microbial Sources.
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- Electroanalysis, 2011, v. 23, n. 10, p. 2320, doi. 10.1002/elan.201100180
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General mass-transfer model for gas phase in structured packings.
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- Chemical Engineering Research & Design: Transactions of the Institution of Chemical Engineers Part A, 2017, v. 126, p. 45, doi. 10.1016/j.cherd.2017.07.034
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On the nature of the burning rate-controlling reaction of energetic materials for the gas-phase model.
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- Combustion, Explosion, & Shock Waves, 2007, v. 43, n. 3, p. 297, doi. 10.1007/s10573-007-0043-0
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Crystal Structure Characterization, Independent Gradient Model Analysis, and Gas‐Phase‐Mediated Transformation of Nicosulfuron DMF Solvate and Hydrate.
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- Crystal Research & Technology, 2019, v. 54, n. 6, p. N.PAG, doi. 10.1002/crat.201800244
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Gas‐Phase Models for the Nickel‐ and Palladium‐Catalyzed Deoxygenation of Fatty Acids.
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- ChemCatChem, 2020, v. 12, n. 21, p. 5476, doi. 10.1002/cctc.202000908
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Investigation of some numerical issues in a chemistry-transport model: Gas-phase simulations.
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- Journal of Geophysical Research. Atmospheres, 2007, v. 112, n. D15, p. n/a, doi. 10.1029/2006JD008373
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Development and initial evaluation of a dynamic species-resolved model for gas phase chemistry and size-resolved gas/particle partitioning associated with secondary organic aerosol formation.
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- Journal of Geophysical Research. Atmospheres, 2005, v. 110, n. D5, p. n/a, doi. 10.1029/2004JD005219
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Atomistic simulations of materials for optical chemical sensors: DFT-D calculations of molecular interactions between gas-phase analyte molecules and simple substrate models.
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- Journal of Molecular Modeling, 2011, v. 17, n. 8, p. 1855, doi. 10.1007/s00894-010-0882-6
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Application of a CFD Code (FLUENT) to Formulate Models of Catalytic Gas Phase Reactions in Porous Catalyst Pellets.
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- Chemical Engineering Research & Design: Transactions of the Institution of Chemical Engineers Part A, 2007, v. 85, n. 11, p. 1539, doi. 10.1205/cherd06226
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The influence of catalyst flow rate and superficial gas velocity on the modified two‐phase model for propylene polymerization in a gas‐phase fluidized bed reactor.
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- Canadian Journal of Chemical Engineering, 2021, v. 99, n. 8, p. 1745, doi. 10.1002/cjce.24021
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Pulsed plasma initiated chemical vapor deposition (PiCVD) of polymer layers − A kinetic model for the description of gas phase to surface interactions in pulsed plasma discharges.
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- Plasma Processes & Polymers, 2018, v. 15, n. 12, p. N.PAG, doi. 10.1002/ppap.201800121
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Modeling of particle growth and morphology in the gas phase polymerization of butadiene. I. Model and its solution method.
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- Journal of Applied Polymer Science, 2001, v. 81, n. 3, p. 719, doi. 10.1002/app.1489
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A Gas‐Phase Ca<sub>n</sub>Mn<sub>4−n</sub>O<sub>4</sub><sup>+</sup> Cluster Model for the Oxygen‐Evolving Complex of Photosystem II.
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- Angewandte Chemie International Edition, 2019, v. 58, n. 25, p. 8504, doi. 10.1002/anie.201903738
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- Publication type:
- Article