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Rational design of stable bimetallic and trimetallic nickel-based single-atom alloys for acetic acid dehydrogenation

NIAID Data Ecosystem2026-05-02 收录

催化剂理性设计

乙酸脱氢催化

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https://zenodo.org/record/11119817 数据链接链接失效反馈

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Data access for the paper publication.

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创建时间：

2024-05-06

催化剂理性设计

生物质转化

The increasing urgency to make chemical processes more environmentally friendly while continuing to derive the chemicals required for modern society from renewable resources requires the development o

NIAID Data Ecosystem80

Iterative Supervised Principal Component Analysis Driven Ligand Design for Regioselective Ti-Catalyzed Pyrrole Synthesis

催化剂理性设计

化学信息学

The rational design of catalysts remains a challenging endeavor within the broader chemical community owing to the myriad variables that can affect key bond-forming events. Designing selective catalys

NIAID Data Ecosystem70

marco-foscato/RuC_BondLength: v1.0.0

催化剂理性设计

烯炔复分解反应

Data, parameters, scripts, and software tools used in de novo design of ruthenium catalyst for olefin metathesis.

Zenodo2024-01-24 更新70

Rational Design of a Second Generation Catalyst for Preparation of Allylsilanes Using the Silyl-Heck Reaction

催化剂理性设计

Heck反应

Using rational ligand design, we have developed of a second-generation ligand, bis(3,5-di-tert-butylphenyl)(tert-butyl)phosphine, for the preparation of allylsilanes using the palladium-catalyzed s

NIAID Data Ecosystem80

Catalyst Design for Alkene Epoxidation by Molecular Analogues of Heterogeneous Titanium-Silicalite Catalysts

催化剂理性设计

烯烃环氧化机理

The epoxidation of allylic alcohols with H2O2 catalyzed by the hybrid [α-B-SbW9O33(tBuSiO)3Ti(OiPr)]3– (1) anion as a molecular model of heterogeneous Ti-silicalite TS-1 catalyst was analyzed by mean

NIAID Data Ecosystem70

Rational design of stable bimetallic and trimetallic nickel-based single-atom alloys for acetic acid dehydrogenation

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