相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Adsorption and sensing behaviors of SF6 decomposed species on Ni-doped C3N monolayer: A first-principles study
Hao Cui et al.
APPLIED SURFACE SCIENCE (2020)
Adsorption of SO2 and NO2 molecule on intrinsic and Pd-doped HfSe2 monolayer: A first-principles study
Hao Cui et al.
APPLIED SURFACE SCIENCE (2020)
Pd-doped MoS2 monolayer: A promising candidate for DGA in transformer oil based on DFT method
Hao Cui et al.
APPLIED SURFACE SCIENCE (2019)
Rh-doped MoSe2 as a toxic gas scavenger: a first-principles study
Hao Cui et al.
NANOSCALE ADVANCES (2019)
Adsorption mechanism of SF6 decomposed species on pyridine-like PtN3 embedded CNT: A DFT study
Hao Cui et al.
APPLIED SURFACE SCIENCE (2018)
Superior Selectivity and Sensitivity of C3N Sensor in Probing Toxic Gases NO2 and SO2
Heping Cui et al.
IEEE ELECTRON DEVICE LETTERS (2018)
Repairing single and double atomic vacancies in a C3N monolayer with CO or NO molecules: a first-principles study
Dongwei Ma et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2018)
A computational study of CO oxidation reactions on metal impurities in graphene divacancies
Yanan Tang et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2018)
C3N monolayers as promising candidates for NO2 sensors
Dongwei Ma et al.
SENSORS AND ACTUATORS B-CHEMICAL (2018)
First Principles Study on the CO Oxidation on Mn-Embedded Divacancy Graphene
Quanguo Jiang et al.
FRONTIERS IN CHEMISTRY (2018)
Computational characterization of monolayer C3N: A two-dimensional nitrogen-graphene crystal
Xiaodong Zhou et al.
JOURNAL OF MATERIALS RESEARCH (2017)
Adsorption of Metallic, Metalloidic, and Nonmetallic Adatoms on Two-Dimensional C3N
Meysam Makaremi et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2017)
Theoretical Investigations of Pt1@CeO2 Single-Atom Catalyst for CO Oxidation
Yan Tang et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2017)
A promising single atom catalyst for CO oxidation: Ag on boron vacancies of h-BN sheets
Zhansheng Lu et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2017)
Single Ni atom incorporated with pyridinic nitrogen graphene as an efficient catalyst for CO oxidation: first-principles investigation
Mingguang Wang et al.
RSC ADVANCES (2017)
2D Frameworks of C2N and C3N as New Anode Materials for Lithium-Ion Batteries
Jiantie Xu et al.
ADVANCED MATERIALS (2017)
C3N-A 2D Crystalline, Hole-Free, Tunable-Narrow-Bandgap Semiconductor with Ferromagnetic Properties
Siwei Yang et al.
ADVANCED MATERIALS (2017)
First-principles study of transition metal adsorbed on porphyrin-like motifs in pyrrolic nitrogen-doped carbon nanostructures
Luis E. Jimenez-Ramirez et al.
CARBON (2017)
Effect of mesoporous g-C3N4 substrate on catalytic oxidation of CO over Co3O4
Heng Yang et al.
APPLIED SURFACE SCIENCE (2017)
Surface chemistry and catalysis confined under two-dimensional materials
Qiang Fu et al.
CHEMICAL SOCIETY REVIEWS (2017)
A new carbon allotrope: Penta-graphene as a metal-free catalyst for CO oxidation
Ranganathan Krishnan et al.
CARBON (2017)
Single-Atom Pt as Co-Catalyst for Enhanced Photocatalytic H2 Evolution
Xiaogang Li et al.
ADVANCED MATERIALS (2016)
Graphdiyne-supported single-atom Sc and Ti catalysts for high-efficient CO oxidation
Zheng-Zhe Lin
CARBON (2016)
Iron-embedded C2N monolayer: a promising low-cost and high-activity single-atom catalyst for CO oxidation
B. L. He et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2016)
A Ti-anchored Ti2CO2 monolayer (MXene) as a single-atom catalyst for CO oxidation
Xu Zhang et al.
JOURNAL OF MATERIALS CHEMISTRY A (2016)
Repairing sulfur vacancies in the MoS2 monolayer by using CO, NO and NO2 molecules
Dongwei Ma et al.
JOURNAL OF MATERIALS CHEMISTRY C (2016)
Recent Advances in Two-Dimensional Materials beyond Graphene
Ganesh R. Bhimanapati et al.
ACS NANO (2015)
CO Oxidation on Gold-Supported Iron Oxides: New Insights into Strong Oxide-Metal Interactions
Liang Yu et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2015)
Pd@Pt Core-Shell Concave Decahedra: A Class of Catalysts for the Oxygen Reduction Reaction with Enhanced Activity and Durability
Xue Wang et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2015)
Dual-immobilized copper catalyst: carbon nitride-supported copper nanopartkles catalyzed oxidation of propargylic alcohols
Wei Lv et al.
TETRAHEDRON LETTERS (2015)
Pt atoms stabilized on hexagonal boron nitride as efficient single-atom catalysts for CO oxidation: a first-principles investigation
Xin Liu et al.
RSC ADVANCES (2015)
Exploration of High-Performance Single-Atom Catalysts on Support M1/FeOx for CO Oxidation via Computational Study
Fengyu Li et al.
ACS CATALYSIS (2015)
New insights into the catalytic activity of gold nanoparticles for CO oxidation in electrochemical media
Paramaconi Rodriguez et al.
JOURNAL OF CATALYSIS (2014)
Graphdiyne as a metal-free catalyst for low-temperature CO oxidation
Ping Wu et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Density functional theory calculations on the CO catalytic oxidation on Al-embedded graphene
Q. G. Jiang et al.
RSC ADVANCES (2014)
Oxygen activation and dissociation on h-BN supported Au atoms
Min Gao et al.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2013)
First-Principles Investigations of Metal (Cu, Ag, Au, Pt, Rh, Pd, Fe, Co, and Ir) Doped Hexagonal Boron Nitride Nanosheets: Stability and Catalysis of CO Oxidation
Sen Lin et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2013)
Synthesis and Characterization of 9 nm Pt-Ni Octahedra with a Record High Activity of 3.3 A/mgPt for the Oxygen Reduction Reaction
Sang-I Choi et al.
NANO LETTERS (2013)
Theoretical investigation on the healing mechanism of divacancy defect in graphene growth by reaction with ethylene and acetylene
Chong Wang et al.
NEW JOURNAL OF CHEMISTRY (2013)
Single Layer of Polymeric Cobalt Phthalocyanine: Promising Low-Cost and High-Activity Nanocatalysts for CO Oxidation
Qingming Deng et al.
SMALL (2013)
Oxidation of Pdn (n=1-5) clusters on single vacancy graphene: A first-principles study
Tian-Tian Jia et al.
COMPUTATIONAL AND THEORETICAL CHEMISTRY (2013)
Chemical Blowing of Thin-Walled Bubbles: High-Throughput Fabrication of Large-Area, Few-Layered BN and Cx-BN Nanosheets
Xuebin Wang et al.
ADVANCED MATERIALS (2011)
Chemisorption of CO and Mechanism of CO Oxidation on Supported Platinum Nanoclusters
Ayman D. Allian et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)
Single-atom catalysis of CO oxidation using Pt1/FeOx
Botao Qiao et al.
NATURE CHEMISTRY (2011)
CO oxidation on PdO surfaces
Janne T. Hirvi et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
CO Catalytic Oxidation on Iron-Embedded Graphene: Computational Quest for Low-Cost Nanocatalysts
Yafei Li et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2010)
Dispersion-corrected Moller-Plesset second-order perturbation theory
Alexandre Tkatchenko et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Metal-Embedded Graphene: A Possible Catalyst with High Activity
Yun-Hao Lu et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2009)
Improving gas sensing properties of graphene by introducing dopants and defects: a first-principles study
Yong-Hui Zhang et al.
NANOTECHNOLOGY (2009)
Enhancement of CO detection in Al doped graphene
Z. M. Ao et al.
CHEMICAL PHYSICS LETTERS (2008)
Improved oxygen reduction activity on Pt3Ni(111) via increased surface site availability
Vojislav R. Stamenkovic et al.
SCIENCE (2007)
Low-temperature catalytic carbon monoxide oxidation over hydrous and anhydrous palladium oxide powders
Seung-Hoon Oh et al.
JOURNAL OF CATALYSIS (2007)
Oxidation of carbon monoxide on Rh(111): A density functional theory study
A. H. Zhang et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
A systematic study of CO oxidation on metals and metal oxides: Density functional theory calculations
XQ Gong et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)
Hardness conserving semilocal pseudopotentials
B Delley
PHYSICAL REVIEW B (2002)
From molecules to solids with the DMol3 approach
B Delley
JOURNAL OF CHEMICAL PHYSICS (2000)