Calculations of current densities for neutral and doubly charged persubstituted benzenes using effective core potentials
Open accessAbstract
Magnetically induced current density of C 6 I 6 2+ using GIMIC method and effective core potentials.
Integrity signals
Registry
Cites
Statistics
Claims the paper makes
Claims other papers make about this one
Each is checked against this paper’s own text: does it say what the citing paper says it does?
These results are consistent with theoretical investigations of the analog C6(SeH)6 2+ reported by Liégeois et al.
“These results are consistent with theoretical investigations of the analog C6(SeH)6 2 + , which have been reported by Liégeois et al. 46 .”
From Double aromaticity arising from σ- and π-rings (2018) · cites this paper as [46]
Cites
Generalized Gradient Approximation Made Simple
Perdew, J. P., Burke, K., & Ernzerhof, M. (1996) · Physical Review Letters · doi:10.1103/physrevlett.77.3865 · Cited by 215,824 · see citing works
Density-functional thermochemistry. III. The role of exact exchange
Becke, A. D. (1993) · The Journal of Chemical Physics · doi:10.1063/1.464913 · Cited by 103,767 · see citing works
Lee, C., Yang, W., & Parr, R. G. (1988) · Physical Review B · doi:10.1103/physrevb.37.785 · Cited by 100,874 · see citing works
Density-functional exchange-energy approximation with correct asymptotic behavior
Becke, A. D. (1988) · Physical Review A · doi:10.1103/physreva.38.3098 · Cited by 53,837 · see citing works
Weigend, F., & Ahlrichs, R. (2005) · Physical Chemistry Chemical Physics · doi:10.1039/b508541a · Cited by 30,761 · see citing works
Accurate and simple analytic representation of the electron-gas correlation energy
Perdew, J. P., & Wang, Y. (1992) · Physical review. B, Condensed matter · doi:10.1103/physrevb.45.13244 · Cited by 25,009 · see citing works
Density-functional approximation for the correlation energy of the inhomogeneous electron gas
Perdew, J. P. (1986) · Physical review. B, Condensed matter · doi:10.1103/physrevb.33.8822 · Cited by 18,762 · see citing works
A new mixing of Hartree–Fock and local density-functional theories
Becke, A. D. (1993) · The Journal of Chemical Physics · doi:10.1063/1.464304 · Cited by 16,515 · see citing works
Electronic structure calculations on workstation computers: The program system turbomole
Ahlrichs, R., Bär, M. R., Häser, M., Horn, H. W., & Kölmel, C. (1989) · Chemical Physics Letters · doi:10.1016/0009-2614(89)85118-8 · Cited by 8,439 · see citing works
Rationale for mixing exact exchange with density functional approximations
Perdew, J. P., Ernzerhof, M., & Burke, K. (1996) · The Journal of Chemical Physics · doi:10.1063/1.472933 · Cited by 6,600 · see citing works
Nucleus-Independent Chemical Shifts: A Simple and Efficient Aromaticity Probe
Schleyer, P. V. R., Maerker, C., Dransfeld, A., Jiao, H., & van Eikema Hommes, N. J. R. (1996) · Journal of the American Chemical Society · doi:10.1021/ja960582d · Cited by 6,210 · see citing works
Nucleus-Independent Chemical Shifts (NICS) as an Aromaticity Criterion
Chen, Z., Wannere, C. S., Corminboeuf, C., Puchta, R., & Schleyer, P. V. R. (2005) · Chemical Reviews · doi:10.1021/cr030088+ · Cited by 3,847 · see citing works
Eichkorn, K., Weigend, F., Treutler, O., & Ahlrichs, R. (1997) · Theoretical Chemistry Accounts · doi:10.1007/s002140050244 · Cited by 3,471 · see citing works
Ab initio energy-adjusted pseudopotentials for elements of groups 13–17
Bergner, A., Dolg, M., Küchle, W., Stoll, H., & Preuß, H. (1993) · Molecular Physics · doi:10.1080/00268979300103121 · Cited by 2,891 · see citing works
Auxiliary basis sets to approximate Coulomb potentials
Eichkorn, K., Treutler, O., Öhm, H., Häser, M., & Ahlrichs, R. (1995) · Chemical Physics Letters · doi:10.1016/0009-2614(95)00621-a · Cited by 2,869 · see citing works
Molecular Electronic‐Structure Theory
Helgaker, T., Jørgensen, P., & Olsen, J. (2000) · doi:10.1002/9781119019572 · Cited by 2,594 · see citing works
Efficient molecular numerical integration schemes
Treutler, O., & Ahlrichs, R. (1995) · The Journal of Chemical Physics · doi:10.1063/1.469408 · Cited by 2,533 · see citing works
Auxiliary basis sets to approximate Coulomb potentials (Chem. Phys. Letters 240 (1995) 283-290)
Eichkorn, K., Treutler, O., Öhm, H., Häser, M., & Ahlrichs, R. (1995) · Chemical Physics Letters · doi:10.1016/0009-2614(95)00838-u · Cited by 1,638 · see citing works
On the Spectroscopic and Thermochemical Properties of ClO, BrO, IO, and Their Anions
Peterson, K. A., Shepler, B. C., Figgen, D., & Stoll, H. (2006) · The Journal of Physical Chemistry A · doi:10.1021/jp065887l · Cited by 828 · see citing works
Calculation of current densities using gauge-including atomic orbitals
Jusélius, J., Sundholm, D., & Gauß, J. (2004) · The Journal of Chemical Physics · doi:10.1063/1.1773136 · Cited by 591 · see citing works
Self-citationAb initio pseudopotentials for Hg through Rn
Küchle, W., Dolg, M., Stoll, H., & Preuss, H. (1991) · Molecular Physics · doi:10.1080/00268979100102941 · Cited by 575 · see citing works
Lazzeretti, P. (2000) · Progress in Nuclear Magnetic Resonance Spectroscopy · doi:10.1016/s0079-6565(99)00021-7 · Cited by 449 · see citing works
Calculations of magnetically induced current densities: theory and applications
Sundholm, D., Fliegl, H., & Berger, R. J. F. (2016) · Wiley Interdisciplinary Reviews Computational Molecular Science · doi:10.1002/wcms.1270 · Cited by 379 · see citing works
Self-citationRing currents and proton magnetic resonance in aromatic molecules
McWeeny, R. (1958) · Molecular Physics · doi:10.1080/00268975800100381 · Cited by 342 · see citing works
Molecular orbital theory of aromatic ring currents
Pople, J. A. (1958) · Molecular Physics · doi:10.1080/00268975800100211 · Cited by 258 · see citing works
Relativistic energy‐consistent pseudopotentials—Recent developments
Stoll, H., Metz, B., & Dolg, M. (2002) · Journal of Computational Chemistry · doi:10.1002/jcc.10037 · Cited by 256 · see citing works
Fliegl, H., Sundholm, D., Taubert, S., Jusélius, J., & Klopper, W. (2009) · The Journal of Physical Chemistry A · doi:10.1021/jp9029776 · Cited by 192 · see citing works
Self-citationCalculation of spin-current densities using gauge-including atomic orbitals
Taubert, S., Sundholm, D., & Jusélius, J. (2011) · The Journal of Chemical Physics · doi:10.1063/1.3549567 · Cited by 186 · see citing works
Self-citationTransformation between Cartesian and pure spherical harmonic Gaussians
Schlegel, H. B., & Frisch, M. J. (1995) · International Journal of Quantum Chemistry · doi:10.1002/qua.560540202 · Cited by 163 · see citing works
Calculations of nuclear magnetic shielding in paramagnetic molecules
Rinkevičius, Ž., Vaara, J., Telyatnyk, L., & Vahtras, O. (2003) · The Journal of Chemical Physics · doi:10.1063/1.1535904 · Cited by 77 · see citing works
Effect of Fluorine Substitution on the Aromaticity of Polycyclic Hydrocarbons
Kaipio, M., Patzschke, M., Fliegl, H., Pichierri, F., & Sundholm, D. (2012) · The Journal of Physical Chemistry A · doi:10.1021/jp308121b · Cited by 70 · see citing works
Self-citationMartins, L. S. C., de Souza, F. A. L., Ceolin, G. A., Jorge, F. E., de Berrêdo, R. C., & Campos, C. T. (2013) · Computational and Theoretical Chemistry · doi:10.1016/j.comptc.2013.03.004 · Cited by 61 · see citing works
Dipositive ion of hexachlorobenzene. Ground-state triplet
Wasserman, E., Hutton, R. S., Kuck, V. J., & Chandross, E. A. (1974) · Journal of the American Chemical Society · doi:10.1021/ja00813a068 · Cited by 59 · see citing works
The stable singlet ground state dication of hexaiodobenzene: possibly a .sigma.-delocalized dication
Sagl, D. J., & Martin, J. C. (1988) · Journal of the American Chemical Society · doi:10.1021/ja00225a038 · Cited by 56 · see citing works
Halogenated Benzene Cation Radicals
Molski, M. J., Mollenhauer, D., Gohr, S., Paulus, B., Khanfar, M. A., Shorafa, H., Strauss, S. H., & Seppelt, K. (2012) · Chemistry - A European Journal · doi:10.1002/chem.201102960 · Cited by 48 · see citing works
Revisiting Aromaticity and Chemical Bonding of Fluorinated Benzene Derivatives
Torres‐Vega, J. J., Vásquez‐Espinal, A., Ruíz, L. M., Fernández‐Herrera, M. A., Alvarez‐Thon, L., Merino, G., & Tiznado, W. (2015) · ChemistryOpen · doi:10.1002/open.201402110 · Cited by 47 · see citing works
How does relativity affect magnetically induced currents?
Berger, R. J. F., Repiský, M., & Komorovský, S. (2015) · Chemical Communications · doi:10.1039/c5cc05732a · Cited by 26 · see citing works
Halogenated Benzene Cation Radicals
Molski, M. J., Khanfar, M. A., Shorafa, H., & Seppelt, K. (2013) · European Journal of Organic Chemistry · doi:10.1002/ejoc.201201691 · Cited by 26 · see citing works
Evidence from current-density mapping for σ-delocalisation in the aromatic hexaiodobenzene cation
Havenith, R. W. A., Fowler, P. W., Fias, S., & Bultinck, P. (2008) · Tetrahedron Letters · doi:10.1016/j.tetlet.2007.12.039 · Cited by 22 · see citing works
Ciofini, I., Lainé, P. P., & Adamo, C. (2006) · Chemical Physics Letters · doi:10.1016/j.cplett.2006.12.058 · Cited by 19 · see citing works
σ-Aromaticity in Hexa-Group 16 Atom-Substituted Benzene Dications: A Theoretical Study
Hatanaka, M., Saito, M., Fujita, M., & Morokuma, K. (2014) · The Journal of Organic Chemistry · doi:10.1021/jo500098h · Cited by 14 · see citing works
Flagged first, then by citations
Cited by
Sorted by citations
Konishi, A., Okada, Y., Kishi, R., Nakano, M., & Yasuda, M. (2018) · Journal of the American Chemical Society · doi:10.1021/jacs.8b11530 · Cited by 77 · see citing works
Double aromaticity arising from σ- and π-rings
Furukawa, S., Fujita, M., Kanatomi, Y., Minoura, M., Hatanaka, M., Morokuma, K., Ishimura, K., & Saito, M. (2018) · Communications Chemistry · doi:10.1038/s42004-018-0057-4 · Cited by 73 · see citing works
Single─Not Double─3D-Aromaticity in an Oxidized Closo Icosahedral Dodecaiodo-Dodecaborate Cluster
Poater, J., Escayola, S., Poater, A., Teixidor, F., Ottosson, H., Viñas, C., & Solà, M. (2023) · Journal of the American Chemical Society · doi:10.1021/jacs.3c07335 · Cited by 58 · see citing works
Orozco‐Ic, M., Soriano-Agueda, L. A., Sundholm, D., Matito, E., & Merino, G. (2024) · Chemical Science · doi:10.1039/d4sc02269f · Cited by 42 · see citing works
Self-citationEscayola, S., Tonnelé, C., Matito, E., Poater, A., Ottosson, H., Solà, M., & Casanova, D. (2021) · Angewandte Chemie International Edition · doi:10.1002/anie.202100261 · Cited by 30 · see citing works
Bicycloaromaticity and Baird-type bicycloaromaticity of dithienothiophene-bridged [34]octaphyrins
Valiev, R. R., Fliegl, H., & Sundholm, D. (2018) · Physical Chemistry Chemical Physics · doi:10.1039/c8cp03112f · Cited by 27 · see citing works
Self-citationMagnetically induced ring currents in metallocenothiaporphyrins
Valiev, R. R., Kurtén, T., Valiulina, L. I., Ketkov, S. Y., Cherepanov, V. N., Dimitrova, M., & Sundholm, D. (2021) · Physical Chemistry Chemical Physics · doi:10.1039/d1cp04779e · Cited by 26 · see citing works
Self-citationMagnetically Induced Current Densities in Toroidal Carbon Nanotubes
Reiter, K., Weigend, F., Wirz, L. N., Dimitrova, M., & Sundholm, D. (2019) · The Journal of Physical Chemistry C · doi:10.1021/acs.jpcc.9b03769 · Cited by 25 · see citing works
Self-citationMetallaantiaromaticity of 10-Platinacorrole Complexes
Miwa, K., Yokota, T., Wang, Q., Sakurai, T., Fliegl, H., Sundholm, D., & Shinokubo, H. (2024) · Journal of the American Chemical Society · doi:10.1021/jacs.3c10250 · Cited by 24 · see citing works
Self-citationRelating nucleus independent chemical shifts with integrated current density strengths
Radenković, S., & Đorđević, S. (2021) · Physical Chemistry Chemical Physics · doi:10.1039/d1cp00784j · Cited by 24 · see citing works
Martins, F. A., & Freitas, M. P. (2019) · European Journal of Organic Chemistry · doi:10.1002/ejoc.201901234 · Cited by 23 · see citing works
Nagami, T., Fujiyoshi, J., Tonami, T., Watanabe, K., Yamane, M., Okada, K., Kishi, R., Nakano, M., Champagne, B. R., & Liégeois, V. (2018) · Chemistry - A European Journal · doi:10.1002/chem.201802696 · Cited by 23 · see citing works
Self-citationAzadiphosphaindane‐1,3‐diyls: A Class of Resonance‐Stabilized Biradicals
Bresien, J., Michalik, D., Schulz, A., Villinger, A., & Zander, E. (2020) · Angewandte Chemie International Edition · doi:10.1002/anie.202011886 · Cited by 21 · see citing works
Amethyrin-type expanded porphyrins that display anti-aromatic character upon protonation
Root, H. D., Mangel, D. N., Brewster, J. T., Zafar, H., Samia, A., Henkelman, G., & Sessler, J. L. (2020) · Chemical Communications · doi:10.1039/d0cc04400h · Cited by 20 · see citing works
Wen, Z., & Wu, J. I.-C. (2020) · Chemical Communications · doi:10.1039/c9cc09670a · Cited by 19 · see citing works
Jena, S., Tulsiyan, K. D., Rana, A., Choudhury, S. S., & Biswal, H. S. (2020) · ChemPhysChem · doi:10.1002/cphc.202000386 · Cited by 17 · see citing works
Stacked antiaromaticity in the π‐congested space between the aromatic rings in the anthracene dimer
Nishiuchi, T., Makihara, Y., Kishi, R., Sato, H., & Kubo, T. (2022) · Journal of Physical Organic Chemistry · doi:10.1002/poc.4451 · Cited by 17 · see citing works
Magnetically-induced current density investigation in carbohelicenes and azahelicenes
Cherni, E., Champagne, B. R., Ayadi, S., & Liégeois, V. (2019) · Physical Chemistry Chemical Physics · doi:10.1039/c9cp02071c · Cited by 16 · see citing works
Self-citationKonishi, A., Horii, K., Iwasa, H., Okada, Y., Kishi, R., Nakano, M., & Yasuda, M. (2021) · Chemistry - An Asian Journal · doi:10.1002/asia.202100398 · Cited by 13 · see citing works
Impact of heteroatoms (S, Se, and Te) on the aromaticity of heterocirculenes
Karaush‐Karmazin, N., Baryshnikov, G., Valiulina, L. I., Valiev, R. R., Ågren, H., & Minaev, B. F. (2019) · New Journal of Chemistry · doi:10.1039/c9nj02468a · Cited by 13 · see citing works
A Triply Linked Porphyrin‐Norcorrole Hybrid with Singlet Diradical Character
Wang, K., Ito, S., Ren, S., Shimizu, D., Fukui, N., Kishi, R., Liu, Q., Osuka, A., Song, J., & Shinokubo, H. (2024) · Angewandte Chemie International Edition · doi:10.1002/anie.202401233 · Cited by 12 · see citing works
Homochiral and Heterochiral Self‐Sorting Assemblies of Antiaromatic Ni(II) Norcorrole Dimers
Liu, S., Li, S., Ukai, S., Nozawa, R., Fukui, N., Sugimori, R., Kishi, R., & Shinokubo, H. (2024) · Chemistry - A European Journal · doi:10.1002/chem.202400292 · Cited by 11 · see citing works
Berger, R. J. F., & Dimitrova, M. (2022) · Physical Chemistry Chemical Physics · doi:10.1039/d2cp02262a · Cited by 10 · see citing works
Delocalization in Substituted Benzene Dications: A Magnetic Point of View
Orozco‐Ic, M., Barroso, J., Islas, R., & Merino, G. (2020) · ChemistryOpen · doi:10.1002/open.202000105 · Cited by 9 · see citing works
Craig-Möbius type antiaromatic chelate ring
Patra, S. G. (2020) · Chemical Physics Letters · doi:10.1016/j.cplett.2020.137093 · Cited by 8 · see citing works
Relativistic effects on the aromaticity of E 3 M 3 H 3 (E = C–Pb; M = N–Bi) benzene analogues
Pino‐Rios, R., Vásquez‐Espinal, A., Alvarez‐Thon, L., & Tiznado, W. (2020) · Physical Chemistry Chemical Physics · doi:10.1039/d0cp04446f · Cited by 8 · see citing works
Yamane, M., Kishi, R., Tonami, T., Okada, K., Nagami, T., Kitagawa, Y., & Nakano, M. (2018) · Asian Journal of Organic Chemistry · doi:10.1002/ajoc.201800390 · Cited by 8 · see citing works
Oxidation-induced double aromaticity in periodo-polycyclic hydrocarbons
Đorđević, S., Poater, J., Solà, M., & Radenković, S. (2025) · Chemical Science · doi:10.1039/d4sc08696a · Cited by 7 · see citing works
Suhrbier, T., Bresien, J., Villinger, A., & Schulz, A. (2022) · Cell Reports Physical Science · doi:10.1016/j.xcrp.2022.100777 · Cited by 7 · see citing works
Access to Benzo‐ and Naphtho‐Azaphospholes via C−H Bond Activation of Aryl‐Substituted Isonitriles
Pilopp, Y., Bresien, J., Gschwind, D. T., Villinger, A., Michalik, D., & Schulz, A. (2023) · Chemistry - A European Journal · doi:10.1002/chem.202300764 · Cited by 7 · see citing works
Aysin, R. R., Leites, L. A., & Bukalov, S. S. (2018) · International Journal of Quantum Chemistry · doi:10.1002/qua.25759 · Cited by 7 · see citing works
Kishi, R., Yamane, M., Sugiura, R., Yoshida, W., Shimizu, Y., & Nakano, M. (2020) · RSC Advances · doi:10.1039/d0ra04787b · Cited by 7 · see citing works
Four‐Centre, Multielectron Bonding in Rare‐Earth Germole Sandwich Complexes
De, S., Mondal, A., Pitcairn, J., Clark, L., Tang, J., Mansikkamäki, A., & Layfield, R. A. (2025) · Angewandte Chemie International Edition · doi:10.1002/anie.202502455 · Cited by 6 · see citing works
Hashimoto, S., & Tahara, K. (2022) · Chemistry · doi:10.3390/chemistry4040102 · Cited by 6 · see citing works
Valiev, R. R., Valiulina, L. I., Fliegl, H., & Sundholm, D. (2020) · New Journal of Chemistry · doi:10.1039/d0nj04470a · Cited by 6 · see citing works
Self-citationFowler, P. W., & Havenith, R. W. A. (2021) · The Journal of Physical Chemistry A · doi:10.1021/acs.jpca.1c03170 · Cited by 6 · see citing works
Escayola, S., Vedin, N. P., Poater, A., Ottosson, H., & Solà, M. (2022) · Journal of Physical Organic Chemistry · doi:10.1002/poc.4447 · Cited by 6 · see citing works
The aromaticity of verdazyl radicals and their closed-shell charged species
Valiev, R. R., Drozdova, A. K., Petunin, P. V., Постников, П. С., Trusova, M. E., Cherepanov, V. N., & Sundholm, D. (2018) · New Journal of Chemistry · doi:10.1039/c8nj04341h · Cited by 6 · see citing works
Self-citationMulticonfigurational actinide nitrides assisted by double Möbius aromaticity
Lin, X., Lu, X.-L., Tang, S., Wu, W., & Mo, Y. (2024) · Chemical Science · doi:10.1039/d4sc01549e · Cited by 5 · see citing works
Four‐Centre, Multielectron Bonding in Rare‐Earth Germole Sandwich Complexes
De, S., Mondal, A., Pitcairn, J., Clark, L., Tang, J., Mansikkamäki, A., & Layfield, R. A. (2025) · Angewandte Chemie · doi:10.1002/ange.202502455 · Cited by 5 · see citing works
Update for Isomerization Stabilization Energies: The Fulvenization Approach
Leyva‐Parra, L., & Pino‐Rios, R. (2023) · ACS Omega · doi:10.1021/acsomega.3c07881 · Cited by 5 · see citing works
Tomut, A.-C., Moraru, I., & Nemes, G. C. (2024) · Molecules · doi:10.3390/molecules29204902 · Cited by 5 · see citing works
Theoretical study on the structures, electronic properties, and aromaticity of thia[4]circulenes
Hashimoto, S., Kishi, R., & Tahara, K. (2022) · New Journal of Chemistry · doi:10.1039/d2nj04359a · Cited by 5 · see citing works
Theoretical investigation of anion perfluorocubane
Martins, G., Castro, T. S., & Ferreira, D. A. C. (2023) · Journal of Molecular Modeling · doi:10.1007/s00894-023-05725-y · Cited by 5 · see citing works
Zárate, X., MacLeod‐Carey, D., Muñoz‐Castro, A., & Schott, E. (2019) · Chemical Physics Letters · doi:10.1016/j.cplett.2019.01.058 · Cited by 4 · see citing works
Azadiphosphaindan‐1,3‐diyle: Eine Gruppe von resonanzstabilisierten Biradikalen
Bresien, J., Michalik, D., Schulz, A., Villinger, A., & Zander, E. (2020) · Angewandte Chemie · doi:10.1002/ange.202011886 · Cited by 3 · see citing works
Saturnenes Like Th@Au6D6h: Ring‐Current Evidence for Au−Au Bonding Along the Gold Ring
Pyykkö, P., & Taubert, S. (2022) · Israel Journal of Chemistry · doi:10.1002/ijch.202100139 · Cited by 3 · see citing works
Self-citationReaction of NHOs with Bisphosphanes – Designing Diradicaloids, Zwitterions and Radicals
Lüdtke, K. P., Zander, E., Taube, F., Siewert, J., Corzilius, B., Hering‐Junghans, C., Bresien, J., & Schulz, A. (2025) · Angewandte Chemie International Edition · doi:10.1002/anie.202423347 · Cited by 2 · see citing works
Creation of (σ+π)-Mixed Delocalization
Saito, M., Suzuki, T., Takahashi, K., Seko, S., Furukawa, S., & Fujii, S. (2023) · Chemistry Letters · doi:10.1246/cl.230279 · Cited by 2 · see citing works
Reaktion von NHOs mit Bisphosphanen – Design von Diradikaloiden, Zwitterionen und Radikalen
Lüdtke, K. P., Zander, E., Taube, F., Siewert, J., Corzilius, B., Hering‐Junghans, C., Bresien, J., & Schulz, A. (2025) · Angewandte Chemie · doi:10.1002/ange.202423347 · Cited by 2 · see citing works
Gibney, D., & Boyn, J.-N. (2025) · The Journal of Physical Chemistry A · doi:10.1021/acs.jpca.5c05283 · Cited by 2 · see citing works
Bismuth Infrared Star: Being at a Glance
Pozdeev, A. S., Rublev, P., & Boldyrev, A. I. (2023) · Chemistry - A European Journal · doi:10.1002/chem.202301663 · Cited by 2 · see citing works
Tetraanion of Tetracyclopentatetraphenylene Derivative: Global Versus Local Conjugation Modes
Miyoshi, H., Sugiura, R., Kishi, R., Muranaka, A., Uchiyama, M., Kobayashi, N., Ie, Y., Nakano, M., & Tobe, Y. (2025) · Chemistry · doi:10.3390/chemistry7020051 · Cited by 1 · see citing works
Oxidation-induced σ-aromaticity in halogenated cycloalkanes
Radenković, S., & Đorđević, S. (2025) · Physical Chemistry Chemical Physics · doi:10.1039/d5cp03126e · Cited by 1 · see citing works
Escayola, S., Solà, M., & Poater, A. (2026) · Chemistry - A European Journal · doi:10.1002/chem.71596 · Cited by 1 · see citing works
Theoretical study on aromatic characters in π-stacked multimers composed of antiaromatic molecules
Sugimori, R., Ikeuchi, M., Kishi, R., & Kitagawa, Y. (2024) · Bulletin of the Chemical Society of Japan · doi:10.1093/bulcsj/uoae133 · Cited by 1 · see citing works
Escayola, S., Tonnelé, C., Matito, E., Poater, A., Ottosson, H., Solà, M., & Casanova, D. (2020) · ChemRxiv · doi:10.26434/chemrxiv.13498515
A Triply Linked Porphyrin‐Norcorrole Hybrid with Singlet Diradical Character
Wang, K., Ito, S., Ren, S., Shimizu, D., Fukui, N., Kishi, R., Liu, Q., Osuka, A., Song, J., & Shinokubo, H. (2024) · Angewandte Chemie · doi:10.1002/ange.202401233
On the Facile Synthesis of Triazaarsoles Using Acyclic Precursors
Szych, L. S., Frost, D. S., Ernst, M., Bresien, J., Weber, M., Puhlmann, A., Sander, L., & Müller, C. (2025) · Chemistry - A European Journal · doi:10.1002/chem.202500514
A Systematic Theory for Universal Explanation ofAromaticity and AntiaromaticityPreprint
Yu, G., Meng, Z., & Liang, G. (2025) · ChemRxiv · doi:10.26434/chemrxiv-2025-z5lf6-v2
Polarity Emergence via Skeletal Topology Rearrangements in Nonbenzenoid Molecular Carbons
Su, J., He, Y., Wang, C., Peng, X., Yang, T., Sheng, X., Liu, J., & Lu, J. (2026) · ACS Nano · doi:10.1021/acsnano.6c04774
Introducing thienobelts: Structure and electronic properties of belt-shaped thienoacenes
Casalegno, M. (2026) · Computational Materials Science · doi:10.1016/j.commatsci.2026.115014
Zhang, S., Ruan, K., Luo, M., Chen, D., Xu, B., Lin, Z., & Xia, H. (2026) · Chem · doi:10.1016/j.chempr.2026.103265
Reviving Fused-ring Currents on Pentagonal Bipyramidal CagesPreprint
Yu, G., Meng, Z., & Liang, G. (2026) · ChemRxiv · doi:10.26434/chemrxiv.15009778/v1
- Authors
- Rauhalahti, M., Taubert, S., Sundholm, D., & Liégeois, V.
- Affiliations
- University of Helsinki (FI)
- University of Namur (BE)
- Corresponding author
- Liégeois, Vincent
- Venue
- Physical Chemistry Chemical Physics
- Publisher
- Royal Society of Chemistry (RSC)
- Published
- 2017
- Volume
- 19
- Issue
- 10
- Pages
- 7124-7131
- ISSN
- 1463-9076 (ISSN-L)
- 1463-9084
- OpenAlex
- W2588630863
- Cited by
- 61
- References
- 41
- Citations by year
- 2026: 4 · 2025: 9 · 2024: 8 · 2023: 6 · 2022: 7 · 2021: 4 · 2020: 11 · 2019: 5 · 2018: 7
- FWCI
- 2.63
- Type
- journal article
- Language
- en
- Open access
- green
- hdl.handle.net
- Licence
- other-oa
- Locations
- Physical Chemistry Chemical Physics (publishedVersion)
- PubMed (publishedVersion)
- Työväentutkimus Vuosikirja (submittedVersion, other-oa)
- Repository of the University of Namur (submittedVersion)
- Funders
- Suomen Akatemia (268251, 275845, 289179)
- Topics
- Physical Sciences › Chemistry › Organic Chemistry › Synthesis and Properties of Aromatic Compounds
- Physical Sciences › Physics and Astronomy › Atomic and Molecular Physics, and Optics › Advanced Chemical Physics Studies
- Physical Sciences › Chemistry › Organic Chemistry › Chemical Reaction Mechanisms
- Keywords
- current density, ring current, radical cations, dication, aromaticity, effective core potentials, molecular orbital calculations
About these checks
Registry, retraction, Cites and statistics results are computed, not judged, with one exception: a printed reference that no index lists is read once by a model before it counts as a citation error. Claims are extracted by a model and kept only when their quote appears verbatim in the text; each cited source is then checked, with a model’s help, for whether it says what the claim relies on. Those verdicts can be wrong — read the claim’s quote and the cited source before relying on one.
Statistics and arithmetic are recomputed, not judged.
Confidence bands are shown only for fields calibrated on our annotated test set. None is calibrated yet, so no band is shown.
What counts as a claim ›How we measure confidence ›How we check this ›
Are you an author, or do you see a problem with this page? Request a review