On the public citation graph

Synergistic Effects of Axial Ligands on the Oer/Orr Catalytic Performance of Cu-N-C Single-Atom Catalysts: A Dft Study

https://doi.org/10.2139/ssrn.5244286
0 signed · 63 inferred · view as graph

Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.

1 of the 63 references listed on this page is in the Retraction Watch database as retracted (export 2026-11-04): 10.1016/j.ijhydene.2021.06.057 (notice 2026-07-16).

Dataset join, best-effort; this page does not check the publisher record. Retraction Watch data via Crossref Labs, used with credit; OpenCitations Index (CC0) and Meta (CC BY 4.0); dataset doi:10.7910/DVN/WT8VOA (CC BY 4.0).

Is this your work? Sign in with ORCID and put your name on the claims that are yours.
Claim with ORCID
Reference health. See whether every reference in this work resolves to a known work and none has been retracted — and get a dated CiteStamped badge you can embed.
See reference health

What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/anie.202113895openalex-snapshot
Metal‐Triazolate‐Framework‐Derived FeN 4 Cl 1 Single‐Atom Catalysts with Hierarchical Porosity for the Oxygen Reduction Reaction
inferredcites →https://doi.org/10.1002/asia.201801052openalex-snapshot
Tunable Electronic and Magnetic Properties of Graphene‐Embedded Transition Metal‐N4 Complexes: Insight From First‐Principles Calculations
inferredcites →https://doi.org/10.1002/chem.202303672openalex-snapshot
Theoretical and Experimental Aspects of Electrocatalysts for Oxygen Evolution Reaction
inferredcites →https://doi.org/10.1002/jcc.20495openalex-snapshot
Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction
inferredcites →https://doi.org/10.1002/jcc.21759openalex-snapshot
Effect of the damping function in dispersion corrected density functional theory
inferredcites →https://doi.org/10.1007/s10562-023-04490-0openalex-snapshot
Tuning the N Coordination Environment of Ir Single-Atom-Catalyst for Highly Efficient ORR and OER: A Computational Study
inferredcites →https://doi.org/10.1007/s10562-024-04728-5openalex-snapshot
Insight into the Mechanism of Dual-metal Atoms on N, S-codoped Graphene toward Oxygen Evolution Reactions: High Performance Inspired by Dual Active Sites
inferredcites →https://doi.org/10.1007/s12274-021-3964-0openalex-snapshot
Coordination environments tune the activity of oxygen catalysis on single atom catalysts: A computational study
inferredcites →https://doi.org/10.1007/s12274-022-4318-2openalex-snapshot
Establishing a theoretical insight for penta-coordinated iron-nitrogen-carbon catalysts toward oxygen reaction
inferredcites →https://doi.org/10.1007/s12274-023-5734-7openalex-snapshot
Enhanced nitrogen electroreduction performance by the reorganization of local coordination environment of supported single atom on N(O)-dual-doped graphene
inferredcites →https://doi.org/10.1016/0927-0256(96)00008-0openalex-snapshot
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
inferredcites →https://doi.org/10.1016/j.apsusc.2022.154832openalex-snapshot
Rational design of the first and second coordination spheres for copper single-atom catalyst to boost highly efficient oxygen reduction
inferredcites →https://doi.org/10.1016/j.apsusc.2023.157581openalex-snapshot
Insights into local coordination environment of main group metal-nitrogen-carbon catalysts for enhanced oxygen reduction reaction
inferredcites →https://doi.org/10.1016/j.apsusc.2024.161555openalex-snapshot
Ab initio calculations of high-entropy clusters for oxygen reduction and evolution as well as CO2 reduction reactions
inferredcites →https://doi.org/10.1016/j.cclet.2020.02.018openalex-snapshot
Transition metal carbides in electrocatalytic oxygen evolution reaction
inferredcites →https://doi.org/10.1016/j.commatsci.2024.113505openalex-snapshot
Mo2B2O2-supported Cu and Ni heterogeneous dual atom catalysts for oxygen reduction reactions and oxygen evolution reactions
inferredcites →https://doi.org/10.1016/j.electacta.2022.140554openalex-snapshot
Atomically dispersed transition metal-N4 doped graphene as a Li O nucleation site in nonaqueous lithium-oxygen batteries
inferredcites →https://doi.org/10.1016/j.fuproc.2023.107879openalex-snapshot
Research progress in graphene based single atom catalysts in recent years
inferredcites →https://doi.org/10.1016/j.ijhydene.2021.06.057openalex-snapshot
RETRACTED: Porous carbon polyhedrons with exclusive Cu-Nx moieties as highly effective electrocatalysts for oxygen reduction reactions
inferredcites →https://doi.org/10.1016/j.jcis.2023.06.066openalex-snapshot
Interface engineering of transition metal-nitrogen-carbon by graphdiyne for boosting the oxygen reduction/evolution reactions: A computational study
inferredcites →https://doi.org/10.1016/j.jcis.2024.03.073openalex-snapshot
Heterojunction of MXenes and MN4–graphene: Machine learning to accelerate the design of bifunctional oxygen electrocatalysts
inferredcites →https://doi.org/10.1016/j.jechem.2023.10.061openalex-snapshot
Heteroatom anchors Fe-Mn dual-atom catalysts with bi-functional oxygen catalytic activity for low-temperature rechargeable flexible Zn-air batteries
inferredcites →https://doi.org/10.1016/j.jelechem.2006.11.008openalex-snapshot
Electrolysis of water on oxide surfaces
inferredcites →https://doi.org/10.1016/j.mcat.2022.112706openalex-snapshot
Transition metal atoms anchored on square graphyne as multifunctional electrocatalysts: A computational investigation
inferredcites →https://doi.org/10.1016/j.mcat.2023.113526openalex-snapshot
Theoretical investigation of d-orbitals involvement in catalytic activity by incorporation of bimetallic on adjacent position
inferredcites →https://doi.org/10.1016/j.renene.2022.12.059openalex-snapshot
Bilayer MN4-O-MN4 by bridge-bonded oxygen ligands: Machine learning to accelerate the design of bifunctional electrocatalysts
inferredcites →https://doi.org/10.1021/acs.jpcc.0c04432openalex-snapshot
Descriptors for Hydrogen Evolution on Single Atom Catalysts in Nitrogen-Doped Graphene
inferredcites →https://doi.org/10.1021/acs.jpcc.3c02628openalex-snapshot
Effect of the Axial Halogen Ligand on the Oxygen Reduction Reaction Performance of Transition Metal–Nitrogen–Carbon Catalysts
inferredcites →https://doi.org/10.1021/acs.jpcc.4c00299openalex-snapshot
Exploring the Inner- and Outer-Sphere Mechanistic Pathways of ORR on M–N–Cs with Pyrrolic MN4 Motifs
inferredcites →https://doi.org/10.1021/acs.jpclett.3c02385openalex-snapshot
Leveraging Interlayer Interaction in M–N–C Catalysts for Enhanced Activity in Oxygen Reduction Reactions
inferredcites →https://doi.org/10.1021/acsaem.9b01066openalex-snapshot
Coordination-Engineered Cu–N x Single-Site Catalyst for Enhancing Oxygen Reduction Reaction
inferredcites →https://doi.org/10.1021/acsami.3c07790openalex-snapshot
Metal-Doped C 3 B Monolayer as the Promising Electrocatalyst for Hydrogen/Oxygen Evolution Reaction: A Combined Density Functional Theory and Machine Learning Study
inferredcites →https://doi.org/10.1021/acscatal.1c02941openalex-snapshot
Acid-Stable and Active M–N–C Catalysts for the Oxygen Reduction Reaction: The Role of Local Structure
inferredcites →https://doi.org/10.1021/acscatal.2c00697openalex-snapshot
Molecularly Engineered Carbon Platform To Anchor Edge-Hosted Single-Atomic M–N/C (M = Fe, Co, Ni, Cu) Electrocatalysts of Outstanding Durability
inferredcites →https://doi.org/10.1021/acsomega.0c04727openalex-snapshot
Theoretical Density Functional Theory Study of Electrocatalytic Activity of MN4-Doped (M = Cu, Ag, and Zn) Single-Walled Carbon Nanotubes in Oxygen Reduction Reactions
inferredcites →https://doi.org/10.1021/acsomega.0c05538openalex-snapshot
Effects of Doped N, B, P, and S Atoms on Graphene toward Oxygen Evolution Reactions
inferredcites →https://doi.org/10.1021/acsphyschemau.2c00003openalex-snapshot
Computational Insight into TM–Nx Embedded Graphene Bifunctional Electrocatalysts for Oxygen Evolution and Reduction Reactions
inferredcites →https://doi.org/10.1021/jacs.1c03788openalex-snapshot
Dynamic Behavior of Single-Atom Catalysts in Electrocatalysis: Identification of Cu-N 3 as an Active Site for the Oxygen Reduction Reaction
inferredcites →https://doi.org/10.1021/jacs.9b11852openalex-snapshot
Boosting Oxygen Reduction of Single Iron Active Sites via Geometric and Electronic Engineering: Nitrogen and Phosphorus Dual Coordination
inferredcites →https://doi.org/10.1038/s41467-020-16848-8openalex-snapshot
Engineering unsymmetrically coordinated Cu-S1N3 single atom sites with enhanced oxygen reduction activity
inferredcites →https://doi.org/10.1039/c9sc05897dopenalex-snapshot
Oxygen evolution reaction: a perspective on a decade of atomic scale simulations
inferredcites →https://doi.org/10.1039/d1ee00154jopenalex-snapshot
Tuning metal single atoms embedded in N x C y moieties toward high-performance electrocatalysis
inferredcites →https://doi.org/10.1039/d2cp00644hopenalex-snapshot
A Synergistic effect on the atomic cluster M 4 supported on MN 4 -graphene (M = Fe, Ni) for the hydrogen evolution reaction
inferredcites →https://doi.org/10.1039/d2nr05974fopenalex-snapshot
Curvature effects on the bifunctional oxygen catalytic performance of single atom metal–N–C
inferredcites →https://doi.org/10.1039/d2ra01956fopenalex-snapshot
Rational design of M–N 4 –Gr/V 2 C heterostructures as highly active ORR catalysts: a density functional theory study
inferredcites →https://doi.org/10.1039/d2ta06050gopenalex-snapshot
Rational design, application and dynamic evolution of Cu–N–C single-atom catalysts
inferredcites →https://doi.org/10.1039/d3cp01168bopenalex-snapshot
Exploring the catalytic activity of graphene-based TM-N x C 4- x single atom catalysts for the oxygen reduction reaction via density functional theory calculation
inferredcites →https://doi.org/10.1063/1.3382344openalex-snapshot
A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
inferredcites →https://doi.org/10.1063/1.447334openalex-snapshot
A unified formulation of the constant temperature molecular dynamics methods
inferredcites →https://doi.org/10.1088/0953-8984/21/8/084204openalex-snapshot
A grid-based Bader analysis algorithm without lattice bias
inferredcites →https://doi.org/10.1103/physrev.140.a1133openalex-snapshot
Self-Consistent Equations Including Exchange and Correlation Effects
inferredcites →https://doi.org/10.1103/physreva.31.1695openalex-snapshot
Canonical dynamics: Equilibrium phase-space distributions
inferredcites →https://doi.org/10.1103/physrevb.13.5188openalex-snapshot
Special points for Brillouin-zone integrations
inferredcites →https://doi.org/10.1103/physrevb.46.13756openalex-snapshot
Energy fluctuations induced by the Nosé thermostat
inferredcites →https://doi.org/10.1103/physrevb.49.14251openalex-snapshot
Ab initio molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
inferredcites →https://doi.org/10.1103/physrevb.50.17953openalex-snapshot
Projector augmented-wave method
inferredcites →https://doi.org/10.1103/physrevb.54.11169openalex-snapshot
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
inferredcites →https://doi.org/10.1103/physrevb.59.1758openalex-snapshot
From ultrasoft pseudopotentials to the projector augmented-wave method
inferredcites →https://doi.org/10.1103/physrevlett.77.3865openalex-snapshot
Generalized Gradient Approximation Made Simple
inferredcites →https://doi.org/10.1143/ptps.103.1openalex-snapshot
Constant Temperature Molecular Dynamics Methods
inferredcites →https://doi.org/10.1186/s40580-022-00324-8openalex-snapshot
Rational coordination regulation in carbon-based single-metal-atom catalysts for electrocatalytic oxygen reduction reaction
inferredcites →https://doi.org/10.3390/molecules29020537openalex-snapshot
RuO2 Catalysts for Electrocatalytic Oxygen Evolution in Acidic Media: Mechanism, Activity Promotion Strategy and Research Progress
inferredcites →https://doi.org/10.3390/pr11020361openalex-snapshot
Recent Progress of Non-Pt Catalysts for Oxygen Reduction Reaction in Fuel Cells
Editorial review for independent work. ICSAC — the Institute for Complexity Science and Advanced Computing — runs a structured editorial panel for researchers publishing outside journals, and publishes on CiteStamp rails. Submission is free and goes through ORCID: icsacinstitute.org/submit.