Works matching DE "UNIMOLECULAR reactions"
Results: 146
IR/UV Double Resonance Study of the 2‐Phenylallyl Radical and its Pyrolysis Products.
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- Chemistry - A European Journal, 2023, v. 29, n. 13, p. 1, doi. 10.1002/chem.202202943
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Acetal‐thiol Click‐like Reaction: Facile and Efficient Synthesis of Dynamic Dithioacetals and Recyclable Polydithioacetals.
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- Angewandte Chemie, 2024, v. 136, n. 31, p. 1, doi. 10.1002/ange.202405653
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Algorithmic Explorations of Unimolecular and Bimolecular Reaction Spaces**.
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- Angewandte Chemie, 2022, v. 134, n. 46, p. 1, doi. 10.1002/ange.202210693
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Monomolecular decay of anion-radicals of isomeric chlorobenzonitriles. Quantum chemical analysis.
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- Journal of Structural Chemistry, 2006, v. 47, n. 2, p. 211, doi. 10.1007/s10947-006-0289-5
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Molecular assembly of nanolayers of water-repellent siloxane coatings on the surface of fibers.
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- Fibre Chemistry, 2012, v. 43, n. 6, p. 433, doi. 10.1007/s10692-012-9378-8
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Kinetic analysis of a general model of activation of aspartic proteinase zymogens involving a reversible inhibitor. I. Kinetic analysis.
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- Journal of Enzyme Inhibition & Medicinal Chemistry, 2007, v. 22, n. 2, p. 147, doi. 10.1080/14756360601114601
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Kinetic analysis of a general model of activation of aspartic proteinase zymogens involving a reversible inhibitor. II. Contribution of the uni- and bimolecular activation routes.
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- Journal of Enzyme Inhibition & Medicinal Chemistry, 2007, v. 22, n. 2, p. 157, doi. 10.1080/14756360601114635
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Charge tunneling and cross recombination at organic heterojunction under electric fields.
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- European Physical Journal B: Condensed Matter, 2007, v. 59, n. 2, p. 151, doi. 10.1140/epjb/e2007-00282-4
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One-step formation of two new unimolecular initiators on the basis of styrene and HO-TEMPO.
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- Designed Monomers & Polymers, 2005, v. 8, n. 3, p. 211, doi. 10.1163/1568555053993961
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A selection rule for the directions of electronic fluxes during unimolecular pericyclic reactions in the electronic ground state.
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- Molecular Physics, 2012, v. 110, n. 9/10, p. 517, doi. 10.1080/00268976.2011.648666
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Is there a space–time continuum in olfaction?
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- Cellular & Molecular Life Sciences, 2009, v. 66, n. 13, p. 2135, doi. 10.1007/s00018-009-0011-9
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Cinética y Mecanismo de la descomposición Térmica del Nipecotato de Etilo e Isonipecotato de Etilo.
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- Información Tecnológica, 2013, v. 24, n. 6, p. 59, doi. 10.4067/S0718-07642013000600009
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Self-assembly of Pseudomonas fluorescens lipase into bimolecular aggregates dramatically affects functional properties.
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- Biotechnology & Bioengineering, 2003, v. 82, n. 2, p. 232, doi. 10.1002/bit.10560
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Exploring unimolecular reactions in disilanol and ethanol: Insights and challenges.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2023, v. 142, n. 12, p. 1, doi. 10.1007/s00214-023-03062-0
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On the decomposition mechanism of propanal: rate constants evaluation and kinetic simulations.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2023, v. 142, n. 11, p. 1, doi. 10.1007/s00214-023-03060-2
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First-principle kinetic studies of unimolecular pyrolysis of isopropyl esters as biodiesel surrogates.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2021, v. 140, n. 8, p. 1, doi. 10.1007/s00214-021-02800-6
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The stability of the double amino acid against decarboxylation in gas and aqueous phases.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2017, v. 136, n. 1, p. 1, doi. 10.1007/s00214-016-2031-5
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Role of water clusters in the reaction of the simplest Criegee intermediate CH2OO with water vapour.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2016, v. 135, n. 11, p. 1, doi. 10.1007/s00214-016-1998-2
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Water-catalyzed decomposition of the simplest Criegee intermediate CH2OO.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2016, v. 135, n. 5, p. 1, doi. 10.1007/s00214-016-1894-9
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Association reaction between SiH and HO: a computational study of the reaction mechanism and kinetics.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2013, v. 132, n. 8, p. 1, doi. 10.1007/s00214-013-1375-3
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Unimolecular decomposition mechanism of vinyl alcohol by computational study.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 128, n. 3, p. 341, doi. 10.1007/s00214-010-0860-1
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Thermal unimolecular decomposition mechanism of 2,4,6-trinitrotoluene: a first-principles DFT study.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2010, v. 127, n. 4, p. 327, doi. 10.1007/s00214-009-0720-z
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Subdiffusion with the disappearance of particles at the time of a jump.
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- Journal of Experimental & Theoretical Physics, 2011, v. 112, n. 6, p. 1071, doi. 10.1134/S1063776111050062
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Determination of Sodium Metamizole by High Performance Liquid Chromatography Taking into Account its Decomposition in Aqueous Solutions in the Study of Dissolution Profiles.
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- Journal of Analytical Chemistry, 2021, v. 76, n. 4, p. 486, doi. 10.1134/S1061934821020052
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Polymerization Effects on the Decomposition of a Pyrazolo‐Triazine at high Temperatures and Pressures.
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- ChemistryOpen, 2020, v. 9, n. 4, p. 470, doi. 10.1002/open.202000006
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Recombination in Dense Ion Plasmas.
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- Contributions to Plasma Physics, 2013, v. 53, n. 10, p. 711, doi. 10.1002/ctpp.201310044
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Factors governing H3+ formation from methyl halogens and pseudohalogens.
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- Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-024-55065-5
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Anharmonic effect of the dissociation rate constant of the unimolecular reactions of CH2XCHFO (X = H, F).
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- Molecular Physics, 2011, v. 109, n. 16, p. 1983, doi. 10.1080/00268976.2011.602648
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Vibrational predissociation of D2HF and H2HF with a new potential energy surface.
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- Molecular Physics, 1998, v. 93, n. 4, p. 619, doi. 10.1080/002689798168952
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Molecular decompositions of acetaldehyde and formamide: theoretical studies using Hartree-Fock, Moller-Plesset and density functional theories.
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- Molecular Physics, 1997, v. 92, n. 3, p. 497, doi. 10.1080/002689797170248
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Relation between activation energy and induction in rubber sulfur vulcanization: An experimental study.
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- Journal of Applied Polymer Science, 2021, v. 138, n. 12, p. 1, doi. 10.1002/app.50073
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Quantification of Unimolecular Photoreaction Kinetics: Determination of Quantum Yields and Development of Actinometers—The Photodegradation Case of Cardiovascular Drug Nisoldipine.
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- International Journal of Photoenergy, 2015, v. 2015, p. 1, doi. 10.1155/2015/454895
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Derivation of atmospheric reaction mechanisms for volatile organic compounds by the SAPRC mechanism generation system (MechGen).
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- Atmospheric Chemistry & Physics, 2025, v. 25, n. 1, p. 199, doi. 10.5194/acp-25-199-2025
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Comparison of isoprene chemical mechanisms under atmospheric night-time conditions in chamber experiments: evidence of hydroperoxy aldehydes and epoxy products from NO3 oxidation.
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- Atmospheric Chemistry & Physics, 2023, v. 23, n. 5, p. 3147, doi. 10.5194/acp-23-3147-2023
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Evaluated kinetic and photochemical data for atmospheric chemistry: Volume VII – Criegee intermediates.
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- Atmospheric Chemistry & Physics, 2020, v. 20, n. 21, p. 13497, doi. 10.5194/acp-20-13497-2020
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Importance of isomerization reactions for OH radical regeneration from the photo-oxidation of isoprene investigated in the atmospheric simulation chamber SAPHIR.
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- Atmospheric Chemistry & Physics, 2020, v. 20, n. 6, p. 3333, doi. 10.5194/acp-20-3333-2020
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Estimation of rate coefficients and branching ratios for reactions of organic peroxy radicals for use in automated mechanism construction.
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- Atmospheric Chemistry & Physics, 2019, v. 19, n. 11, p. 7691, doi. 10.5194/acp-19-7691-2019
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Synthesis of Amphiphilic Three-Armed Star Random Copolymers via Living Radical Polymerization and their Unimolecular Folding Properties in Water.
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- Macromolecular Symposia, 2015, v. 350, n. 1, p. 76, doi. 10.1002/masy.201400027
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THE QUEST FOR UNIMOLECULAR RECTIFICATION FROM OXFORD TO WALTHAM TO EXETER TO TUSCALOOSA.
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- Journal of Macromolecular Science: Pure & Applied Chemistry, 2001, v. 38, n. 12, p. 1499, doi. 10.1081/MA-100108401
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High-Temperature Cracking of Pentene to Ethylene and Propylene over H-ZSM-5 Zeolites: Effect of Reaction Conditions and Mechanistic Insights.
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- Catalysts (2073-4344), 2023, v. 13, n. 1, p. 73, doi. 10.3390/catal13010073
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THEORETICAL STUDIES OF ANHARMONIC EFFECT IN THE RICE–RAMSPERGER–KASSEL–MARCUS THEORY.
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- Modern Physics Letters B, 2008, v. 22, n. 31, p. 3043, doi. 10.1142/S0217984908017552
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Asymmetric Rh Diene Catalysis under Confinement: Isoxazole Ring‐Contraction in Mesoporous Solids.
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- European Journal of Organic Chemistry, 2024, v. 27, n. 31, p. 1, doi. 10.1002/ejoc.202400283
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Insight into catalytic cracking pathways of n‐pentane over bifunctional catalysts to produce light olefins.
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- AIChE Journal, 2024, v. 70, n. 2, p. 1, doi. 10.1002/aic.18266
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Surface-Mediated Heterogeneous Catalysis.
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- Chemical Engineering, 2019, v. 126, n. 7, p. N.PAG
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OH regeneration from methacrolein oxidation investigated in the atmosphere simulation chamber SAPHIR.
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- Atmospheric Chemistry & Physics, 2014, v. 14, n. 15, p. 7895, doi. 10.5194/acp-14-7895-2014
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Stochastic modeling analysis of sequential first-order degradation reactions and non-Fickian transport in steady state plumes.
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- Water Resources Research, 2014, v. 50, n. 2, p. 1260, doi. 10.1002/2013WR013814
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Multiarm star-like unimolecular micelles with a dendritic core and a dual thermosensitive shell.
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- Polymer International, 2011, v. 60, n. 5, p. 717, doi. 10.1002/pi.2989
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Experimental and theoretical study of the thermal decomposition of ethyl acetate during fast pyrolysis.
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- Chemical Engineering Research & Design: Transactions of the Institution of Chemical Engineers Part A, 2020, v. 157, p. 153, doi. 10.1016/j.cherd.2020.03.001
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Hexanal Formation via Lipid Oxidation as a Function of Oxygen Concentration: Measurement and Kinetics.
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- Journal of Food Science (Wiley-Blackwell), 1991, v. 56, n. 3, p. 816, doi. 10.1111/j.1365-2621.1991.tb05389.x
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Formation of Van Der Waals Complexes in Concerted Unimolecular Elimination Processes.
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- ISRN Physical Chemistry, 2012, p. 1, doi. 10.5402/2012/431367
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