
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:
Best‐Practice DFT Protocols for Basic Molecular Computational Chemistry**
Markus Bursch, Jan‐Michael Mewes, Andreas Hansen, et al.
Angewandte Chemie (2022) Vol. 134, Iss. 42
Open Access | Times Cited: 88
Markus Bursch, Jan‐Michael Mewes, Andreas Hansen, et al.
Angewandte Chemie (2022) Vol. 134, Iss. 42
Open Access | Times Cited: 88
Showing 26-50 of 88 citing articles:
An overview of the density functional theory on antioxidant bioactivity predictive feasibilities: Insights from natural antioxidant products
Lina M. Shaker, Ahmed A. Al‐Amiery, Talib K. Abed, et al.
Journal of Molecular Structure (2023) Vol. 1301, pp. 137393-137393
Closed Access | Times Cited: 12
Lina M. Shaker, Ahmed A. Al‐Amiery, Talib K. Abed, et al.
Journal of Molecular Structure (2023) Vol. 1301, pp. 137393-137393
Closed Access | Times Cited: 12
Synthesis, characterization and structure–property study of new push–pull carbazole materials
Anoir Hfaiedh, Makrem Labiedh, A. Mabrouk, et al.
Macromolecular Research (2023) Vol. 31, Iss. 10, pp. 981-999
Closed Access | Times Cited: 11
Anoir Hfaiedh, Makrem Labiedh, A. Mabrouk, et al.
Macromolecular Research (2023) Vol. 31, Iss. 10, pp. 981-999
Closed Access | Times Cited: 11
Quantum chemical studies of carbon-based graphene-like nanostructures: from benzene to coronene
Alberto Soares Vanny, Arlan da Silva Gonçalves
Journal of Molecular Modeling (2025) Vol. 31, Iss. 2
Closed Access
Alberto Soares Vanny, Arlan da Silva Gonçalves
Journal of Molecular Modeling (2025) Vol. 31, Iss. 2
Closed Access
Diverse synthetic approaches to 3-arylmethylidene- and bis-3,5-arylmethylidene-N-benzylpiperidin-4-ones with thiophene scaffolds: The comparative experimental study
Zita Tokárová, Natália Kabaňová, Júlia Korcová, et al.
Journal of Molecular Structure (2025), pp. 142133-142133
Closed Access
Zita Tokárová, Natália Kabaňová, Júlia Korcová, et al.
Journal of Molecular Structure (2025), pp. 142133-142133
Closed Access
Tests of the DFT Ladder for the Fulminic Acid Challenge
Ashley M. Allen, Laura N. Olive, Patricia A. Gonzalez Franco, et al.
Journal of the American Chemical Society (2025)
Closed Access
Ashley M. Allen, Laura N. Olive, Patricia A. Gonzalez Franco, et al.
Journal of the American Chemical Society (2025)
Closed Access
Feed-Forward Neural Network for Predicting Enantioselectivity of the Asymmetric Negishi Reaction
Abbigayle E. Cuomo, Sebastian Ibarraran, Sanil Sreekumar, et al.
ACS Central Science (2023) Vol. 9, Iss. 9, pp. 1768-1774
Open Access | Times Cited: 9
Abbigayle E. Cuomo, Sebastian Ibarraran, Sanil Sreekumar, et al.
ACS Central Science (2023) Vol. 9, Iss. 9, pp. 1768-1774
Open Access | Times Cited: 9
Dispersion-corrected r2SCAN based double-hybrid functionals
Lukas Wittmann, Hagen Neugebauer, Stefan Grimme, et al.
The Journal of Chemical Physics (2023) Vol. 159, Iss. 22
Open Access | Times Cited: 9
Lukas Wittmann, Hagen Neugebauer, Stefan Grimme, et al.
The Journal of Chemical Physics (2023) Vol. 159, Iss. 22
Open Access | Times Cited: 9
Ab Initio and Kinetic Modeling of β-d -Xylopyranose under Fast Pyrolysis Conditions
Jacopo Lupi, Leandro Ayarde‐Henríquez, Mark Kelly, et al.
The Journal of Physical Chemistry A (2024) Vol. 128, Iss. 6, pp. 1009-1024
Open Access | Times Cited: 3
Jacopo Lupi, Leandro Ayarde‐Henríquez, Mark Kelly, et al.
The Journal of Physical Chemistry A (2024) Vol. 128, Iss. 6, pp. 1009-1024
Open Access | Times Cited: 3
Unveiling the Antioxidative Potential of Galangin: Complete and Detailed Mechanistic Insights through Density Functional Theory Studies
Maciej Spiegel
The Journal of Organic Chemistry (2024) Vol. 89, Iss. 12, pp. 8676-8690
Open Access | Times Cited: 3
Maciej Spiegel
The Journal of Organic Chemistry (2024) Vol. 89, Iss. 12, pp. 8676-8690
Open Access | Times Cited: 3
In silico modelling of radiative efficiencies of anthropogenic greenhouse gases
Daniela Alejandra Alvarado-Jiménez, Nicola Tasinato
Atmospheric Environment (2024), pp. 120839-120839
Open Access | Times Cited: 3
Daniela Alejandra Alvarado-Jiménez, Nicola Tasinato
Atmospheric Environment (2024), pp. 120839-120839
Open Access | Times Cited: 3
London Dispersion Effects in a Distannene/Tristannane Equilibrium: Energies of their Interconversion and the Suppression of the Monomeric Stannylene Intermediate
Wenxing Zou, Markus Bursch, Kristian L. Mears, et al.
Angewandte Chemie International Edition (2023) Vol. 62, Iss. 22
Open Access | Times Cited: 7
Wenxing Zou, Markus Bursch, Kristian L. Mears, et al.
Angewandte Chemie International Edition (2023) Vol. 62, Iss. 22
Open Access | Times Cited: 7
Investigating the accuracy of density functional methods for molecules in electric fields
Tarek Scheele, Tim Stauch
The Journal of Chemical Physics (2023) Vol. 159, Iss. 12
Open Access | Times Cited: 7
Tarek Scheele, Tim Stauch
The Journal of Chemical Physics (2023) Vol. 159, Iss. 12
Open Access | Times Cited: 7
Theoretical study of the influence of electron push or pull bipyridine ligands on the electronic structure of Eu3+ ibuprofenate complexes
Leonardo A. De Souza, Larissa P.N.M. Pinto, Júlia P.O. Silva, et al.
Computational and Theoretical Chemistry (2024) Vol. 1232, pp. 114459-114459
Closed Access | Times Cited: 2
Leonardo A. De Souza, Larissa P.N.M. Pinto, Júlia P.O. Silva, et al.
Computational and Theoretical Chemistry (2024) Vol. 1232, pp. 114459-114459
Closed Access | Times Cited: 2
On the origin of optical rotation changes during the κ-carrageenan disorder-to-order transition
Benjamin P. Westberry, Maguy Del Rio, Mark R. Waterland, et al.
Carbohydrate Polymers (2024) Vol. 333, pp. 121975-121975
Open Access | Times Cited: 2
Benjamin P. Westberry, Maguy Del Rio, Mark R. Waterland, et al.
Carbohydrate Polymers (2024) Vol. 333, pp. 121975-121975
Open Access | Times Cited: 2
Benchmark Study on the Calculation of 207Pb NMR Chemical Shifts
Thomas Gasevic, Julius B. Kleine Büning, Stefan Grimme, et al.
Inorganic Chemistry (2024) Vol. 63, Iss. 11, pp. 5052-5064
Open Access | Times Cited: 2
Thomas Gasevic, Julius B. Kleine Büning, Stefan Grimme, et al.
Inorganic Chemistry (2024) Vol. 63, Iss. 11, pp. 5052-5064
Open Access | Times Cited: 2
Unveiling the Antioxidative Potential of Galangin: Complete and Detailed Mechanistic Insights through Density Functional Theory Studies
Maciej Spiegel
(2024)
Open Access | Times Cited: 2
Maciej Spiegel
(2024)
Open Access | Times Cited: 2
Determining the hydrocarbon chain growth pathway in Fischer–Tropsch synthesis through DFT calculations: impact of cobalt cluster size
Somayyeh Veiskarami, Ali Nakheai Pour, Ehsan Saljoughi, et al.
New Journal of Chemistry (2024) Vol. 48, Iss. 22, pp. 9990-10001
Closed Access | Times Cited: 2
Somayyeh Veiskarami, Ali Nakheai Pour, Ehsan Saljoughi, et al.
New Journal of Chemistry (2024) Vol. 48, Iss. 22, pp. 9990-10001
Closed Access | Times Cited: 2
∆DFT predicts inverted singlet-triplet gaps with chemical accuracy at a fraction of the cost of wavefunction-based approaches
Lukas Kunze, Thomas Froitzheim, Andreas Hansen, et al.
(2024)
Open Access | Times Cited: 2
Lukas Kunze, Thomas Froitzheim, Andreas Hansen, et al.
(2024)
Open Access | Times Cited: 2
Surface Wettability Analysis from Adsorption Energy and Surface Electrical Charge
Chen Zhang, Xuming Wang, Lixia Li, et al.
Minerals (2024) Vol. 14, Iss. 6, pp. 628-628
Open Access | Times Cited: 2
Chen Zhang, Xuming Wang, Lixia Li, et al.
Minerals (2024) Vol. 14, Iss. 6, pp. 628-628
Open Access | Times Cited: 2
Relative Stability of Pyrazinamide Polymorphs Revisited: A Computational Study of Bending and Brittle Forms Phase Transitions in a Broad Temperature Range
Aleksandr S. Dubok, Denis A. Rychkov
Crystals (2023) Vol. 13, Iss. 4, pp. 617-617
Open Access | Times Cited: 6
Aleksandr S. Dubok, Denis A. Rychkov
Crystals (2023) Vol. 13, Iss. 4, pp. 617-617
Open Access | Times Cited: 6
Exploring the second-order polarizability of copper doped silicon carbide nanocluster: toward a new NLO material
Junaid Yaqoob, Sobia Tabassum, Hamad AlMohamadi, et al.
Physica Scripta (2023) Vol. 98, Iss. 9, pp. 095516-095516
Closed Access | Times Cited: 6
Junaid Yaqoob, Sobia Tabassum, Hamad AlMohamadi, et al.
Physica Scripta (2023) Vol. 98, Iss. 9, pp. 095516-095516
Closed Access | Times Cited: 6
“Vermellogens” and the Development of CB[8]-Based Supramolecular Switches Using pH-Responsive and Non-Toxic Viologen Analogues
Liliana Barravecchia, Arturo Blanco‐Gómez, Iago Neira, et al.
Journal of the American Chemical Society (2022) Vol. 144, Iss. 41, pp. 19127-19136
Open Access | Times Cited: 10
Liliana Barravecchia, Arturo Blanco‐Gómez, Iago Neira, et al.
Journal of the American Chemical Society (2022) Vol. 144, Iss. 41, pp. 19127-19136
Open Access | Times Cited: 10
Three‐Component Synthesis of Dioxaphosphorane‐Fused Diphosphacycles Exhibiting Unique Dynamic Fluorescence “On/Off” Properties
Chenchen Li, Haiyang Huang, Longgen Sun, et al.
Angewandte Chemie International Edition (2022) Vol. 62, Iss. 6
Closed Access | Times Cited: 9
Chenchen Li, Haiyang Huang, Longgen Sun, et al.
Angewandte Chemie International Edition (2022) Vol. 62, Iss. 6
Closed Access | Times Cited: 9
Two Shared Icosahedral Metallacarboranes through Iron: A Joint Experimental and Theoretical Refinement of Mössbauer Spectrum in [Fe(1,2-C2B9H11)2]Cs
José F. Marco, Juan Z. Dávalos, Drahomı́r Hnyk, et al.
ACS Omega (2023) Vol. 8, Iss. 15, pp. 13993-14004
Open Access | Times Cited: 5
José F. Marco, Juan Z. Dávalos, Drahomı́r Hnyk, et al.
ACS Omega (2023) Vol. 8, Iss. 15, pp. 13993-14004
Open Access | Times Cited: 5
Electronic structures of zwitterionic and protonated forms of glycine betaine in water: Insights into solvent effects from ab initio simulations
Jiang Liu, Kang Zheng
Journal of Molecular Liquids (2022) Vol. 369, pp. 120871-120871
Closed Access | Times Cited: 8
Jiang Liu, Kang Zheng
Journal of Molecular Liquids (2022) Vol. 369, pp. 120871-120871
Closed Access | Times Cited: 8