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A quantum-chemical study of adsorbed nonclassical carbonium ions as active intermediates in catalytic transformations of paraffins. I. Protolytic cracking of ethane on high silica zeolites

https://doi.org/10.1007/bf00813921
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Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1007/978-1-4613-4455-1openalex-snapshot
Interaction Between Ions and Molecules
inferredcites →https://doi.org/10.1007/bf00764193openalex-snapshot
Quantum chemical studies of ethylene interaction with zeolite OH-groups
inferredcites →https://doi.org/10.1007/bf00773185openalex-snapshot
Lattice relaxation of zeolites
inferredcites →https://doi.org/10.1016/0021-9517(88)90040-1openalex-snapshot
Heterogeneity of OH groups in NaH$z.sbnd;ZSM-5 zeolite studied by infrared spectroscopy
inferredcites →https://doi.org/10.1016/0021-9517(92)90075-sopenalex-snapshot
Study of the mechanism of the cracking of small alkane molecules on HY Zeolites
inferredcites →https://doi.org/10.1016/0021-9517(92)90273-kopenalex-snapshot
Monomolecular and bimolecular mechanisms of paraffin cracking: n-butane cracking catalyzed by HZSM-5
inferredcites →https://doi.org/10.1016/0144-2449(89)90052-3openalex-snapshot
Determination of proton affinity of zeolites and zeolite-like solids by low-temperature adsorption of carbon monoxide
inferredcites →https://doi.org/10.1016/0304-5102(91)80049-9openalex-snapshot
Rates of isobutane cracking catalysed by HZSM-5: The carbonium ion route
inferredcites →https://doi.org/10.1016/s0020-1693(00)84345-5openalex-snapshot
Ab initio molecular orbital theory
inferredcites →https://doi.org/10.1021/ar50107a003openalex-snapshot
Ab initio molecular orbital theory
inferredcites →https://doi.org/10.1021/j100180a068openalex-snapshot
Interaction of ammonia with a zeolitic proton: ab initio quantum-chemical cluster calculations
inferredcites →https://doi.org/10.1021/j100198a044openalex-snapshot
Computational studies of acid sites in ZSM 5: dependence on cluster size
inferredcites →https://doi.org/10.1021/ja00436a009openalex-snapshot
Stabilities and energetics of pentacoordinated carbonium ions. The isomeric protonated ethane ions and some higher analogs: protonated propane and protonated butane
inferredcites →https://doi.org/10.1038/363529a0openalex-snapshot
Understanding the acid behaviour of zeolites from theory and experiment

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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Kinetic Analysis of Monomolecular Cracking of Normal Alkanes (C4-6) Over Brønsted Acid Site of Zeolitic Type Catalyst with Evaluation of Transition State Based on Quantum-Chemical Modeling
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Impact of confinement on zeolite cracking selectivity via Monte Carlo integration
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A quantum-chemical study of adsorbed nonclassical carbonium ions as active intermediates in catalytic transformations of paraffins. II. Protolytic dehydrogenation and hydrogen-deuterium hetero-isotope exchange of paraffins on high-silica zeolites
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A periodic density functional theory study of gallium-exchanged mordenite
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Microkinetic modeling of propane aromatization over HZSM-5
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Adsorption and cracking of propane by zeolites of different pore size
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Predicting transition state and activation energies in n-hexane cracking over zeolites: Combined DFT calculations and estimations with the SISSO method
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RETRACTED: Kinetic analysis of monomolecular cracking of normal Alkanes (C4C6) over Brønsted Acid site of Zeolitic type catalyst with energetic evaluation of transition states using Quantum-Chemical modeling
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Cracking of n-heptane over Brønsted acid sites and Lewis acid Ga sites in ZSM-5 zeolite
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Applicability of protolytic mechanism to steady-state heterogeneous dehydrogenation of ethane revisited
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An ab initio study of ethane conversion reactions on zeolites using the complete basis set composite energy method
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A computational study of alkane hydrogen-exchange reactions on zeolites
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A computational study of methane catalytic reactions on zeolites
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Density functional theory study of relevant properties of lanthanum species and 1-butene activation over lanthanum modified zeolite
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Protolytic cracking of low-molecular-weight alkanes in the presence of iron- and manganese-promoted sulfated zirconia: evidence of a compensation effect
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Quantum-chemical study of the nonclassical carbonium ion-like transition states in isobutane cracking on zeolites
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Quantum-chemical study of hydride transfer in catalytic transformation of paraffins on zeolites
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The Molecular Basis of Zeolite Catalysis:A Review of Theoretical Simulations
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NMR Studies of Solid Acidity
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Theory, spectroscopy and kinetics of zeolite catalysed reactions
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Adsorbed carbocations as transition states in heterogeneous acid catalyzed transformations of hydrocarbons
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Reaction mechanisms and kinetics in the n-hexane cracking over zeolites
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Sorption and activation of hydrocarbons by molecular sieves
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Computational study on the product selectivity of FCC zeolitic catalyst
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The Haag–Dessau mechanism of protolytic cracking of alkanes
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Hexane Cracking on ZSM-5 and Faujasite Zeolites: a QM/MM/QCT Study
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Monomolecular Cracking of Propane: Effect of Zeolite Confinement and Acidity
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Incorporation of Gallium into Zeolites: Syntheses, Properties and Catalytic Application
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Toward Better Understanding of the Catalytic Action of Acidic Zeolites: Investigation in Methane and Ethane Activation and Transformation
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Mechanisms and Kinetics of Reactions Leading to Natural Gas Formation during Coal Maturation
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Reactivity of Alkanes on Zeolites: A Computational Study of Propane Conversion Reactions
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Effect of the Zeolite Nanocavity on the Reaction Mechanism of n-Hexane Cracking: A Density Functional Theory Study
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Activation of C−H and C−C Bonds by an Acidic Zeolite: A Density Functional Study
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Cracking of Hydrocarbons on Zeolite Catalysts: Density Functional and Hartree−Fock Calculations on the Mechanism of the β-Scission Reaction
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Isotopic Tracer Studies of Propane Reactions on H−ZSM5 Zeolite
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Ab Initio and Density Functional Study of the Activation Barrier for Ethane Cracking in Cluster Models of Zeolite H-ZSM-5
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H–D exchange between CD4 and solid acids: AlCl3/sulfonic acid resin, promoted and unpromoted sulfated zirconia, and zeolite HZSM-5
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The First Observation of the Broad-Range DRIFT Spectrum of Methane Adsorbed on H-Mordenite
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A quantum-chemical study of hydride transfer in catalytic transformations of paraffins on zeolites. Pathways through adsorbed nonclassical carbonium ions
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Quantum chemical studies of zeolite proton catalyzed reactions
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A theoretical explanation of solvent effects in zeolite catalysis
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Quantum-chemical modeling of the hydrocarbon transformations in acid zeolite catalysts
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Solid-acid-catalyzed alkane cracking mechanisms: evidence from reactions of small probe molecules
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Electronic structure studies of carbonium ions and their formation within acidic zeolites
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Pillared layered structuresvs. zeolites as sorbents and catalysts
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Density functional studies of carbonium ions
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The Acidity of Zeolites: Concepts, Measurements and Relation to Catalysis: A Review on Experimental and Theoretical Methods for the Study of Zeolite Acidity
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Propane Aromatization over HZSM‐5 and Ga/HZSM‐5 Catalysts
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Ethane to Aromatic Hydrocarbons: Past, Present, Future
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CHEMICAL MECHANISMS OF CATALYTIC CRACKING OVER SOLID ACIDIC CATALYSTS: ALKANES AND ALKENES
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Kinetic Analysis of Monomolecular Cracking of Normal Alkanes (C4–C6) over Brønsted Acid Site of Zeolitic Type Catalyst with Energetic Evaluation of Transition States Using Quantum-Chemical Modeling
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Mechanisms of light alkane and alkene activation and transformation on metal-modified zeolites
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Préparation et caractérisation de zéolithes dopées par des métaux de transition : mesure de propriétés diélectriques et magnétiques et leur application à la synthèse de composés chimiques sous irradiation microondes
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Synthèse d’essences hybrides par co-traitement de distillats de pétrole et d’huiles de pyrolyse de bio-masse en craquage catalytique
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