Related references
Note: Only part of the references are listed.Computational screening of single transition-metal atoms anchored to g-C9N4 as catalysts for N2 reduction to NH3
Xuxin Kang et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2022)
Understanding the origin for propane non-oxidative dehydrogenation catalysed by d2-d8 transition metals
Jianwen Liu et al.
JOURNAL OF CATALYSIS (2021)
First-principles investigation of dehydrogenation of Cu-doped LiBH4
Xiaohua Mo et al.
SOLID STATE COMMUNICATIONS (2021)
Single metal atom anchored on a CN monolayer as an excellent electrocatalyst for the nitrogen reduction reaction
Zhaoqin Chu et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2021)
Regulation of the Interface Binding and Elastic Properties of SiC/Ti via Doping-Induced Electronic Localization
Tingbo Zhang et al.
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS (2020)
Impact of Approximate DFT Density Delocalization Error on Potential Energy Surfaces in Transition Metal Chemistry
Fang Liu et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2020)
Single Vanadium Atoms Anchored on Graphitic Carbon Nitride as a High-Performance Catalyst for Non-oxidative Propane Dehydrogenation
Ningning Kong et al.
ACS NANO (2020)
Theoretical Investigation of On-Purpose Propane Dehydrogenation over the Two-Dimensional Ru-Pc Framework
Kaifeng Niu et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2019)
Cr doped mesoporous silica spheres for propane dehydrogenation in the presence of CO2: Effect of Cr adding time in sol-gel process
Hao-Miao Wang et al.
MICROPOROUS AND MESOPOROUS MATERIALS (2019)
Sulfur (VI) modified graphite carbon nitride nanosheets with chrysanthemum-like structure and enhanced photocatalytic activity
Lili Xie et al.
CHEMICAL PHYSICS LETTERS (2018)
Theoretical Insight into Catalytic Propane Dehydrogenation on Ni(111)
Tinnakorn Saelee et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2018)
Suppression of Hydrogen Evolution Reaction in Electrochemical N-2 Reduction Using Single-Atom Catalysts: A Computational Guideline
Changhyeok Choi et al.
ACS CATALYSIS (2018)
Catalytic function of VOx/Al2O3 for oxidative dehydrogenation of propane: support microstructure-dependent mass transfer and diffusion
Qun-Xing Luo et al.
CATALYSIS SCIENCE & TECHNOLOGY (2018)
Transition metal anchored C2N monolayers as efficient bifunctional electrocatalysts for hydrogen and oxygen evolution reactions
Xu Zhang et al.
JOURNAL OF MATERIALS CHEMISTRY A (2018)
Graphene Defects Trap Atomic Ni Species for Hydrogen and Oxygen Evolution Reactions
Longzhou Zhang et al.
CHEM (2018)
High-Density Ultra-small Clusters and Single-Atom Fe Sites Embedded in Graphitic Carbon Nitride (g-C3N4) for Highly Efficient Catalytic Advanced Oxidation Processes
Sufeng An et al.
ACS NANO (2018)
Theoretical investigation on structural effects of Pt-Mn catalyst on activity and selectivity for methylcyclohexane dehydrogenation
Shota Manabe et al.
CHEMICAL PHYSICS LETTERS (2018)
Propane dehydrogenation over supported Pt-Sn nanoparticles
Nicholas Kaylor et al.
JOURNAL OF CATALYSIS (2018)
The Positive Role of Hydrogen on the Dehydrogenation of Propane on Pt(111)
Stephanie Saerens et al.
ACS CATALYSIS (2017)
Origin of the Robust Catalytic Performance of Nanodiamond Graphene-Supported Pt Nanoparticles Used in the Propane Dehydrogenation Reaction
Jie Liu et al.
ACS CATALYSIS (2017)
The Nature of the Isolated Gallium Active Center for Propane Dehydrogenation on Ga/SiO2
Viktor J. Cybulskis et al.
CATALYSIS LETTERS (2017)
Hydrothermal conversion of biomass waste to activated carbon with high porosity: A review
Akshay Jain et al.
CHEMICAL ENGINEERING JOURNAL (2016)
The role of metallic Sn species in catalytic dehydrogenation of propane: Active component rather than only promoter
Guowei Wang et al.
JOURNAL OF CATALYSIS (2016)
N-, P- and B-doped mesoporous carbons for direct dehydrogenation of propane
Yuejun Song et al.
RSC ADVANCES (2016)
Al2O3 Nanosheets Rich in Pentacoordinate Al3+ Ions Stabilize Pt-Sn Clusters for Propane Dehydrogenation
Lei Shi et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2015)
A Stable Single-Site Palladium Catalyst for Hydrogenations
Gianvito Vile et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2015)
First-principles study on the electronic and magnetic properties of armchair graphane/graphene heterostructure nanoribbons
W. X. Zhang et al.
SOLID STATE COMMUNICATIONS (2015)
Phonon and electronic properties of Ti2SiC from first-principles calculations
Hui Li et al.
SOLID STATE COMMUNICATIONS (2015)
Visualisation of single atom dynamics and their role in nanocatalysts under controlled reaction environments
Pratibha L. Gai et al.
CHEMICAL PHYSICS LETTERS (2014)
Catalytic Dehydrogenation of Light Alkanes on Metals and Metal Oxides
Jesper J. H. B. Sattler et al.
CHEMICAL REVIEWS (2014)
Tuning selectivity and stability in propane dehydrogenation by shaping Pt particles: A combined experimental and DFT study
Ming-Lei Yang et al.
JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL (2014)
Selectivity in Propene Dehydrogenation on Pt and Pt3Sn Surfaces from First Principles
Lauri Nykanen et al.
ACS CATALYSIS (2013)
Synthesis of ordered mesoporous carbon materials and their catalytic performance in dehydrogenation of propane to propylene
Lei Liu et al.
CATALYSIS TODAY (2012)
Preparation of Highly Dispersed Chromium Oxide Catalysts Supported on Mesoporous Silica for the Oxidative Dehydrogenation of Propane Using CO2: Insight into the Nature of Catalytically Active Chromium Sites
Jayeon Baek et al.
ACS CATALYSIS (2012)
First-Principles Calculations of Propane Dehydrogenation over PtSn Catalysts
Ming-Lei Yang et al.
ACS CATALYSIS (2012)
Ordered mesoporous carbon catalyst for dehydrogenation of propane to propylene
Lei Liu et al.
CHEMICAL COMMUNICATIONS (2011)
Linear Alkane Polymerization on a Gold Surface
Dingyong Zhong et al.
SCIENCE (2011)
Density functional study of the chemisorption of C1, C2 and C3 intermediates in propane dissociation on Pt(111)
Ming-Lei Yang et al.
JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL (2010)
Oxidative Dehydrogenation of Hydrocarbons by V3O7+ Compared to Other Vanadium Oxide Species
Xavier Rozanska et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2009)
Oxidative conversion of C1-C3 alkanes by vanadium oxide catalysts. DFT results and their accuracy
Xavier Rozanska et al.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2008)
Chain growth mechanism in Fischer-Tropsch synthesis: A DFT study of C-C coupling over Ru, Fe, Rh, and Re surfaces
Jun Cheng et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2008)
Hydrogen storage using functionalized saturated hydrocarbons
Manh Cuong Nguyen et al.
SOLID STATE COMMUNICATIONS (2008)
Theoretical study of dehydrogenation and isomerisation reactions of propylene on Pt(111)
Ana Valcarcel et al.
JOURNAL OF CATALYSIS (2006)
Dehydrogenation of propane to propene over different polymorphs of gallium oxide
B Zheng et al.
JOURNAL OF CATALYSIS (2005)