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Size-Dependent Reaction Mechanism and Kinetics for Propane Dehydrogenation over Pt Catalysts

ACS catalysis, 2015-11, Vol.5 (11), p.6310-6319

2015

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Density Functional Theory-Assisted Microkinetic Analysis of Methane Dry Reforming on Ni Catalyst

Industrial & engineering chemistry research, 2015-06, Vol.54 (22), p.5901-5913

2015

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Dual‐function catalysis in propane dehydrogenation over Pt1–Ga2O3 catalyst: Insights from a microkinetic analysis

AIChE journal, 2020-07, Vol.66 (7), p.n/a

2020

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Characterization of surface oxygen complexes on carbon nanofibers by TPD, XPS and FT-IR

Carbon (New York), 2007-04, Vol.45 (4), p.785-796

2007

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Rational design of intermetallic compound catalysts for propane dehydrogenation from a descriptor-based microkinetic analysis

Journal of catalysis, 2021-12, Vol.404, p.32-45

2021

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Effects of Oxygen Vacancy and Pt Doping on the Catalytic Performance of CeO2 in Propane Dehydrogenation: A First‐Principles Study

Chinese journal of chemistry, 2021-09, Vol.39 (9), p.2391-2402

2021

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Self-adaptive structure and catalytic performance of the Pt–Sn/Al2O3 propane dehydrogenation catalyst regenerated by dichloroethane oxychlorination

Catalysis science & technology, 2022-11, Vol.12 (23), p.7171-7181

2022

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Rational screening of single-atom-doped ZnO catalysts for propane dehydrogenation from microkinetic analysis

Catalysis science & technology, 2020-08, Vol.1 (15), p.4938-4951

2020

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Surface phase diagrams of La-based perovskites towards the O-rich limit from first principles

Physical chemistry chemical physics : PCCP, 2019-06, Vol.21 (24), p.12859-12871

2019

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Tuning selectivity and stability in propane dehydrogenation by shaping Pt particles: A combined experimental and DFT study

Journal of molecular catalysis. A, Chemical, 2014-12, Vol.395, p.329-336

2014

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Toward rational catalyst design for partial hydrogenation of dimethyl oxalate to methyl glycolate: a descriptor-based microkinetic analysis

Catalysis science & technology, 2019, Vol.9 (2), p.5763-5773

2019

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DFT study of propane dehydrogenation on Pt catalyst: effects of step sites

Physical chemistry chemical physics : PCCP, 2011, Vol.13 (8), p.3257

2011

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On the ensemble requirement of fully selective chemical looping methane partial oxidation over La-Fe-based perovskites

Applied catalysis. B, Environmental, 2022-02, Vol.301, p.120788, Article 120788

2022

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First-Principles Calculations of Propane Dehydrogenation over PtSn Catalysts

ACS catalysis, 2012-06, Vol.2 (6), p.1247-1258

2012

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Coke Formation on Pt–Sn/Al2O3 Catalyst for Propane Dehydrogenation

Industrial & engineering chemistry research, 2018-07, Vol.57 (26), p.8647-8654

2018

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High-Throughput Screening of Alloy Catalysts for Dry Methane Reforming

ACS catalysis, 2021-07, Vol.11 (14), p.8881-8894

2021

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Improved selectivity and coke resistance of core-shell alloy catalysts for propane dehydrogenation from first principles and microkinetic analysis

Chemical engineering journal (Lausanne, Switzerland : 1996), 2019-12, Vol.377 (C), p.120049, Article 120049

2019

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Rational Design of Single-Atom-Doped Ga2O3 Catalysts for Propane Dehydrogenation: Breaking through Volcano Plot by Lewis Acid–Base Interactions

ACS catalysis, 2021-05, Vol.11 (9), p.5135-5147

2021

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Tailoring catalytic properties of V2O3 to propane dehydrogenation through single-atom doping: A DFT study

Catalysis today, 2021-05, Vol.368, p.46-57

2021

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Beyond the Reverse Horiuti–Polanyi Mechanism in Propane Dehydrogenation over Pt Catalysts

ACS catalysis, 2020-12, Vol.10 (24), p.14887-14902

2020

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Density functional study of the chemisorption of C1, C2 and C3 intermediates in propane dissociation on Pt(111)

Journal of molecular catalysis. A, Chemical, 2010-04, Vol.321 (1-2), p.42-49

2010

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Identifying the Active Phase on Atomically Dispersed Catalysts for Propane Dehydrogenation: Positively Charged vs Metallic Transition Metals

ACS catalysis, 2024-06, Vol.14 (11), p.8602-8618

2024

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Insights into Hydrogen Transport Behavior on Perovskite Surfaces: Transition from the Grotthuss Mechanism to the Vehicle Mechanism

Langmuir, 2019-07, Vol.35 (30), p.9962-9969

2019

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Enhanced catalytic performance of transition metal-doped Cr2O3 catalysts for propane dehydrogenation: A microkinetic modeling study

Chemical engineering journal (Lausanne, Switzerland : 1996), 2022-10, Vol.446, p.136913, Article 136913

2022

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Tuning Adsorption and Catalytic Properties of α‑Cr2O3 and ZnO in Propane Dehydrogenation by Creating Oxygen Vacancy and Doping Single Pt Atom: A Comparative First-Principles Study

Industrial & engineering chemistry research, 2019-06, Vol.58 (24), p.10199-10209

2019

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Size-Dependent Reaction Mechanism and Kinetics for Propane Dehydrogenation over Pt Catalysts

Density Functional Theory-Assisted Microkinetic Analysis of Methane Dry Reforming on Ni Catalyst

Dual‐function catalysis in propane dehydrogenation over Pt1–Ga2O3 catalyst: Insights from a microkinetic analysis

Characterization of surface oxygen complexes on carbon nanofibers by TPD, XPS and FT-IR

Rational design of intermetallic compound catalysts for propane dehydrogenation from a descriptor-based microkinetic analysis

Effects of Oxygen Vacancy and Pt Doping on the Catalytic Performance of CeO2 in Propane Dehydrogenation: A First‐Principles Study

Self-adaptive structure and catalytic performance of the Pt–Sn/Al2O3 propane dehydrogenation catalyst regenerated by dichloroethane oxychlorination

Rational screening of single-atom-doped ZnO catalysts for propane dehydrogenation from microkinetic analysis

Surface phase diagrams of La-based perovskites towards the O-rich limit from first principles

Tuning selectivity and stability in propane dehydrogenation by shaping Pt particles: A combined experimental and DFT study

Toward rational catalyst design for partial hydrogenation of dimethyl oxalate to methyl glycolate: a descriptor-based microkinetic analysis

DFT study of propane dehydrogenation on Pt catalyst: effects of step sites

On the ensemble requirement of fully selective chemical looping methane partial oxidation over La-Fe-based perovskites

First-Principles Calculations of Propane Dehydrogenation over PtSn Catalysts

Coke Formation on Pt–Sn/Al2O3 Catalyst for Propane Dehydrogenation

High-Throughput Screening of Alloy Catalysts for Dry Methane Reforming

Improved selectivity and coke resistance of core-shell alloy catalysts for propane dehydrogenation from first principles and microkinetic analysis

Rational Design of Single-Atom-Doped Ga2O3 Catalysts for Propane Dehydrogenation: Breaking through Volcano Plot by Lewis Acid–Base Interactions

Tailoring catalytic properties of V2O3 to propane dehydrogenation through single-atom doping: A DFT study

Beyond the Reverse Horiuti–Polanyi Mechanism in Propane Dehydrogenation over Pt Catalysts

Density functional study of the chemisorption of C1, C2 and C3 intermediates in propane dissociation on Pt(111)

Identifying the Active Phase on Atomically Dispersed Catalysts for Propane Dehydrogenation: Positively Charged vs Metallic Transition Metals

Insights into Hydrogen Transport Behavior on Perovskite Surfaces: Transition from the Grotthuss Mechanism to the Vehicle Mechanism

Enhanced catalytic performance of transition metal-doped Cr2O3 catalysts for propane dehydrogenation: A microkinetic modeling study

Tuning Adsorption and Catalytic Properties of α‑Cr2O3 and ZnO in Propane Dehydrogenation by Creating Oxygen Vacancy and Doping Single Pt Atom: A Comparative First-Principles Study

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