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DFT Study of Closed and Open Sites of BEA, FAU, MFI, and BEC Zeolites Substituted with Tin and Titanium
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Outgoing claims: the papers this work cites, builds on, or argues with.
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Simple and Scalable Preparation of Highly Active Lewis Acidic Sn‐β
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NMR Signatures of the Active Sites in Sn‐β Zeolite
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Synthesis of Sn‐Beta with Exclusive and High Framework Sn Content
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Atomic charges derived from semiempirical methods
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Structural Characterization of Ti-Silicalite-1: A Synchrotron Radiation X-Ray Powder Diffraction Study
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Epoxidation of Crotyl Alcohol Using Ti-Containing Heterogeneous Catalysts: Comments on the Loss of Ti by Leaching
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The Structure of Small Molecules and Ions
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Energy-adjustedab initio pseudopotentials for the second and third row transition elements
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Chemical hardness and density functional theory
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Acidity and defect sites in titanium silicalite catalyst
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Preparation of Ti incorporated Y zeolites by a post-synthesis method under acidic conditions and their catalytic properties
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Solid-state MAS NMR detection of the oxidation center in TS-1 zeolite by in situ probe reaction
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Determination of the catalytically active oxidation Lewis acid sites in Sn-beta zeolites, and their optimisation by the combination of theoretical and experimental studies
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Zeolite H-USY for the production of lactic acid and methyl lactate from C3-sugars
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Acid strength and solvation in catalysis by MFI zeolites and effects of the identity, concentration and location of framework heteroatoms
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Incorporation of titanium into polymorph C for catalytic epoxidation of cyclohexene
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Tin-containing zeolite for the isomerization of cellulosic sugars
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Relation between structure and Lewis acidity of Ti-Beta and TS-1 zeolites
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Orthorhombic to monoclinic phase transition in high-Ti-loaded TS-1: an attempt to locate Ti in the MFI framework by low temperature XRD
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The Strength of Brønsted Acid Sites in Microporous Aluminosilicates
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Activation of Carbonyl-Containing Molecules with Solid Lewis Acids in Aqueous Media
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UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations
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Ti Location in the MFI Framework of Ti−Silicalite-1: A Neutron Powder Diffraction Study
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Al-Free Sn-Beta Zeolite as a Catalyst for the Selective Reduction of Carbonyl Compounds (Meerwein−Ponndorf−Verley Reaction)
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Evidence of Defect-Promoted Reactivity for Epoxidation of Propylene in Titanosilicate (TS-1) Catalysts: A DFT Study
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Uniform Catalytic Site in Sn-β-Zeolite Determined Using X-ray Absorption Fine Structure
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Quantum Chemical Modeling of Zeolite-Catalyzed Methylation Reactions: Toward Chemical Accuracy for Barriers
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Implications of Transition State Confinement within Small Voids for Acid Catalysis
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DFT Study of the Lewis Acidities and Relative Hydrothermal Stabilities of BEC and BEA Zeolites Substituted with Ti, Sn, and Ge
inferredcites →https://doi.org/10.1021/jp805400uopenalex-snapshot
Synthesis of the Ti−Silicate Form of BEC Polymorph of β-Zeolite Assisted by Molecular Modeling
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Sn-zeolite beta as a heterogeneous chemoselective catalyst for Baeyer–Villiger oxidations
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Long-range corrected hybrid density functionals with damped atom–atom dispersion corrections
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inferredcites →https://doi.org/10.1039/c3ra42530dopenalex-snapshot
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Catalysis by Microporous Materials
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Incoming claims: where this work appears in other papers’ reference lists and arguments.
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