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Adsorption of Propane, Isopropyl, and Hydrogen on Cluster Models of the M1 Phase of Mo−V−Te−Nb−O Mixed Metal Oxide Catalyst

https://doi.org/10.1021/jp910382x
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inferred← citeshttps://doi.org/10.2139/ssrn.4673737openalex-extracted
A Dft-Based Mechanistic Analysis for the M1 Surface of the Movnbteo Catalyst During the Production of Ethylene and Water Via the Selective Oxidation of Ethane
inferred← citeshttps://doi.org/10.1002/9781119379256.ch9openalex-snapshot
Gas‐Phase Oxidation of Alkanes
inferred← citeshttps://doi.org/10.1002/cctc.201100049openalex-snapshot
STEM HAADF Image Simulation of the Orthorhombic M1 Phase in the Mo‐V‐Nb‐Te‐O Propane Oxidation Catalyst
inferred← citeshttps://doi.org/10.1002/cctc.202001642openalex-snapshot
Roles of Enhancement of C−H Activation and Diminution of C−O Formation Within M1‐Phase Pores in Propane Selective Oxidation
inferred← citeshttps://doi.org/10.1007/978-3-319-43104-8_1openalex-snapshot
Design of Catalysts, Characterization, Kinetics and Mechanisms of Reactions, Deactivation/Regeneration
inferred← citeshttps://doi.org/10.1007/s10562-021-03538-3openalex-snapshot
Probing the Positions of TeO Moieties in the Channels of the MoVNbTeO M1 Catalyst: A Density Functional Theory Model Study
inferred← citeshttps://doi.org/10.1007/s11244-011-9682-1openalex-snapshot
Propane Ammoxidation Over the Mo–V–Te–Nb–O M1 Phase: Reactivity of Surface Cations in Hydrogen Abstraction Steps
inferred← citeshttps://doi.org/10.1007/s11244-011-9683-0openalex-snapshot
Active Sites for Propane Oxidation: Some Generic Considerations
inferred← citeshttps://doi.org/10.1007/s11244-011-9684-zopenalex-snapshot
Improvement of the Structural Model for the M1 Phase Mo–V–Nb–Te–O Propane (Amm)oxidation Catalyst
inferred← citeshttps://doi.org/10.1007/s11244-014-0280-xopenalex-snapshot
Propane Ammoxidation over Mo–V–Te–Nb–O M1 Phase Investigated by DFT: Elementary Steps of Ammonia Adsorption, Activation and NH Insertion into π-Allyl Intermediate
inferred← citeshttps://doi.org/10.1007/s11244-020-01327-7openalex-snapshot
Toward Concurrent Engineering of the M1-Based Catalytic Systems for Oxidative Dehydrogenation (ODH) of Alkanes
inferred← citeshttps://doi.org/10.1016/b978-0-12-814807-5.00007-3openalex-snapshot
Recent Applications of Nanometal Oxide Catalysts in Oxidation Reactions
inferred← citeshttps://doi.org/10.1016/j.apcatb.2025.125194openalex-snapshot
Oxidative dehydrogenation of ethane (ODHE) to ethylene by bulk MoVNbTe mixed oxide M1 phase catalysts
inferred← citeshttps://doi.org/10.1016/j.catcom.2012.09.020openalex-snapshot
A combined HAADF STEM and density functional theory study of tantalum and niobium locations in the Mo–V–Te–Ta(Nb)–O M1 phases
inferred← citeshttps://doi.org/10.1016/j.cattod.2011.11.018openalex-snapshot
Highly active and selective supported bulk nanostructured MoVNbTeO catalysts for the propane ammoxidation process
inferred← citeshttps://doi.org/10.1016/j.cattod.2014.02.053openalex-snapshot
Propane ammoxidation over Mo–V–Te–Nb–O M1 phase: Density functional theory study of propane oxidative dehydrogenation steps
inferred← citeshttps://doi.org/10.1016/j.ccr.2014.12.003openalex-snapshot
Mixed-oxide catalysts with vanadium as the key element for gas-phase reactions
inferred← citeshttps://doi.org/10.1016/j.cej.2025.159252openalex-snapshot
Multiscale analysis of the M1 MoVNbTeO catalyst for ethylene production via selective ethane oxidation: From atomistic calculations to the industrial reactor
inferred← citeshttps://doi.org/10.1016/j.comptc.2014.06.016openalex-snapshot
DFT cluster model study of MoVO-type mixed-metal oxides
inferred← citeshttps://doi.org/10.1016/j.jcat.2013.07.019openalex-snapshot
Synergetic effect of VOx and TeOx species in mesoporous SiO2 on selective oxidation of propane to acrolein
inferred← citeshttps://doi.org/10.1016/s1872-2067(15)60905-6openalex-snapshot
DFT studies on the activation of C–H bonds on V/P mixed oxides
inferred← citeshttps://doi.org/10.1021/acs.chemmater.6b05224openalex-snapshot
Synthesis of Crystalline Microporous Mo–V–Bi Oxide for Selective (Amm)Oxidation of Light Alkanes
inferred← citeshttps://doi.org/10.1021/acs.jpca.8b05331openalex-snapshot
DFT Variants for Mixed-Metal Oxides. Benchmarks Using Multi-Center Cluster Models
inferred← citeshttps://doi.org/10.1021/acs.jpcc.4c02899openalex-snapshot
Quantum Chemical Modeling of the Full Catalytic Cycle for Selective Oxidation of Propane to Propene on the M1 Phase of Mo–Te–Nb–O Mixed-Metal Oxide Catalysts
inferred← citeshttps://doi.org/10.1021/acs.jpcc.9b07778openalex-snapshot
Effects of Lattice O Atom Coordination and Pore Confinement on Selectivity Limitations for Ethane Oxidative Dehydrogenation Catalyzed by Vanadium-Oxo Species
inferred← citeshttps://doi.org/10.1021/acscatal.7b01498openalex-snapshot
How High Valence Transition Metal Spreads Its Activity over Nonmetal Oxoes: A Proof-of-Concept Study
inferred← citeshttps://doi.org/10.1021/jacs.5b07073openalex-snapshot
In Silico Design of Highly Selective Mo-V-Te-Nb-O Mixed Metal Oxide Catalysts for Ammoxidation and Oxidative Dehydrogenation of Propane and Ethane
inferred← citeshttps://doi.org/10.1021/jp2088274openalex-snapshot
Unraveling the Reaction Mechanism for Nickel-Catalyzed Oxidative Dehydrogenation of Ethane by DFT: The C–H Bond Activation Step and Its Following Pathways
inferred← citeshttps://doi.org/10.1039/c5dt01694kopenalex-snapshot
Structure and electronic properties of MoVO type mixed-metal oxides – a combined view by experiment and theory
inferred← citeshttps://doi.org/10.1039/c8cy02545bopenalex-snapshot
Reactivity trends of the MoVO x mixed metal oxide catalyst from density functional modeling
inferred← citeshttps://doi.org/10.3390/catal13030628openalex-snapshot
Coal as an Effective Catalyst for Selective Oxidative Dehydrogenation of Propane to Propene
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