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OpenAlex is a bibliographic catalogue of scientific papers, authors and institutions accessible in open access mode, named after the Library of Alexandria. It's citation coverage is excellent and I hope you will find utility in this listing of citing articles!

If you click the article title, you'll navigate to the article, as listed in CrossRef. If you click the Open Access links, you'll navigate to the "best Open Access location". Clicking the citation count will open this listing for that article. Lastly at the bottom of the page, you'll find basic pagination options.

Requested Article:

Analysis of the Geometric and Electronic Structure of Spin-Coupled Iron–Sulfur Dimers with Broken-Symmetry DFT: Implications for FeMoco
Bardi Benediktsson, Ragnar Björnsson
Journal of Chemical Theory and Computation (2022) Vol. 18, Iss. 3, pp. 1437-1457
Open Access | Times Cited: 31

Showing 1-25 of 31 citing articles:

Multiscale QM/MM modelling of catalytic systems with ChemShell
You Lü, Kakali Sen, Chin W. Yong, et al.
Physical Chemistry Chemical Physics (2023) Vol. 25, Iss. 33, pp. 21816-21835
Open Access | Times Cited: 30
Benchmarking Density Functional Theory Methods for Metalloenzyme Reactions: The Introduction of the MME55 Set
Dominique A. Wappett, Lars Goerigk
Journal of Chemical Theory and Computation (2023) Vol. 19, Iss. 22, pp. 8365-8383
Open Access | Times Cited: 20
Understanding the Electronic Structure Basis for N2 Binding to FeMoco: A Systematic Quantum Mechanics/Molecular Mechanics Investigation
Yunjie Pang, Ragnar Björnsson
Inorganic Chemistry (2023) Vol. 62, Iss. 14, pp. 5357-5375
Open Access | Times Cited: 15
[4Fe–4S]-Mediated Proton-Coupled Electron Transfer Enables the Efficient Degradation of Chloroalkenes by Reductive Dehalogenases
Xuan Zhang, Zikuan Wang, Zhen Li, et al.
ACS Catalysis (2023) Vol. 13, Iss. 2, pp. 1173-1185
Closed Access | Times Cited: 13
The protein phosphorylation landscape in photosystem I of the desert algae Chlorella sp.
Guy Levin, Michael Yasmin, Tomasz Pieńko, et al.
New Phytologist (2024) Vol. 242, Iss. 2, pp. 544-557
Open Access | Times Cited: 4
Adsorption of synthetic cationic dyes from water (experimental, DFT and Monte Carlo studies) and treatment of real industrial wastewater using dextrose compound-modified layered double hydroxide
Youssef Rachid, Abdallah El-Asri, Jamila El Gaayda, et al.
Process Safety and Environmental Protection (2024)
Closed Access | Times Cited: 4
Quantum Chemical Topological Analysis of [2Fe2S] Core in Novel [FeFe]-Hydrogenase Mimics
Piotr Matczak
Crystals (2025) Vol. 15, Iss. 1, pp. 52-52
Open Access
Quantum Coulombic Interactions Mediate Free Radical Control in Radical SAM Viperin/RSAD2
M. Hossein Khalilian, Gino A. DiLabio
Journal of the American Chemical Society (2025)
Closed Access
Exploring the high sensitivity of DFT thermochemistry for protonation states of a ferredoxin model complex [CH3S4Fe2IIIS2H]−
Victor P. Vysotskiy, Ulf Ryde
The Journal of Chemical Physics (2025) Vol. 162, Iss. 16
Open Access
N2binding to the E0–E4states of nitrogenase
Hao Jiang, Ulf Ryde
Dalton Transactions (2023) Vol. 52, Iss. 26, pp. 9104-9120
Open Access | Times Cited: 9
The binding of reducible N2 in the reaction domain of nitrogenase
Ian Dance
Dalton Transactions (2023) Vol. 52, Iss. 7, pp. 2013-2026
Closed Access | Times Cited: 7
Restricted Open-Shell Hartree–Fock Method for a General Configuration State Function Featuring Arbitrarily Complex Spin-Couplings
Tiago Leyser da Costa Gouveia, Dimitrios Maganas, Frank Neese
The Journal of Physical Chemistry A (2024) Vol. 128, Iss. 25, pp. 5041-5053
Open Access | Times Cited: 2
Importance of Electron Correlation on the Geometry and Electronic Structure of [2Fe–2S] Systems: A Benchmark Study of the [Fe2S2(SCH3)4]2–,3–,4–, [Fe2S2(SCys)4]2–, [Fe2S2(S-p-tol)4]2–, and [Fe2S2(S-o-xyl)4]2– Complexes
Demeter Tzeli, Pavlo Golub, Jiří Brabec, et al.
Journal of Chemical Theory and Computation (2024)
Closed Access | Times Cited: 2
QM/MM Study of Partial Dissociation of S2B for the E2 Intermediate of Nitrogenase
Hao Jiang, Oskar K. G. Svensson, Ulf Ryde
Inorganic Chemistry (2022) Vol. 61, Iss. 45, pp. 18067-18076
Open Access | Times Cited: 12
The E3 state of FeMoco: one hydride, two hydrides or dihydrogen?
Yunjie Pang, Ragnar Björnsson
Physical Chemistry Chemical Physics (2023) Vol. 25, Iss. 31, pp. 21020-21036
Open Access | Times Cited: 6
Structural correlations of nitrogenase active sites using nuclear resonance vibrational spectroscopy and QM/MM calculations
Casey Van Stappen, Bardi Benediktsson, Atanu Rana, et al.
Faraday Discussions (2023) Vol. 243, pp. 253-269
Open Access | Times Cited: 4
Protonation of Homocitrate and the E1 State of Fe-Nitrogenase Studied by QM/MM Calculations
Hao Jiang, Kristina Lundgren, Ulf Ryde
Inorganic Chemistry (2023) Vol. 62, Iss. 48, pp. 19433-19445
Open Access | Times Cited: 4
Scalar Relativistic All-Electron and Pseudopotential Ab Initio Study of a Minimal Nitrogenase [Fe(SH)4H]− Model Employing Coupled-Cluster and Auxiliary-Field Quantum Monte Carlo Many-Body Methods
Victor P. Vysotskiy, Claudia Filippi, Ulf Ryde
The Journal of Physical Chemistry A (2024) Vol. 128, Iss. 7, pp. 1358-1374
Open Access | Times Cited: 1
Correlating Structure with Spectroscopy in Ascorbate Peroxidase Compound II
Mursaleem Ansari, Sinjini Bhattacharjee, Dimitrios A. Pantazis
Journal of the American Chemical Society (2024) Vol. 146, Iss. 14, pp. 9640-9656
Open Access | Times Cited: 1
Active‐learning for global optimization of Ni‐Ceria nanoparticles: The case of Ce4−xNixO8−x (x = 1, 2, 3)
Lizandra Barrios-Herrera, Maicon Pierre Lourenço, Jiří Hostaš, et al.
Journal of Computational Chemistry (2024) Vol. 45, Iss. 19, pp. 1643-1656
Open Access | Times Cited: 1
Putative reaction mechanism of nitrogenase with a half-dissociated S2B ligand
Hao Jiang, Ulf Ryde
Dalton Transactions (2024) Vol. 53, Iss. 27, pp. 11500-11513
Open Access | Times Cited: 1
Probing the performance of DFT in the structural characterization of [FeFe] hydrogenase models
Piotr Matczak, Philipp Buday, Stephan Kupfer, et al.
Journal of Computational Chemistry (2024)
Closed Access | Times Cited: 1
Insights into Application Research of the Density Functional Theory in Iron Sulfur Compounds: A Bibliometric Mapping Analysis
Jie Mu, Jianhai Wang, Wenjing Ji, et al.
ACS Omega (2024) Vol. 9, Iss. 47, pp. 46679-46697
Open Access | Times Cited: 1
Multireference Protonation Energetics of a Dimeric Model of Nitrogenase Iron–Sulfur Clusters
Huanchen Zhai, Seunghoon Lee, Zhi‐Hao Cui, et al.
The Journal of Physical Chemistry A (2023) Vol. 127, Iss. 47, pp. 9974-9984
Open Access | Times Cited: 3
Benchmarking Density Functional Theory Methods for Metalloenzyme Reactions: The Introduction of the MME55 Set
Dominique A. Wappett, Lars Goerigk
(2023)
Open Access | Times Cited: 2
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