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Number of items: 18.

Article

Dunning, Thom, Xu, Lu, Cooper, David L. et al. (1 more author) (2021) Spin-Coupled Generalized Valence Bond Theory: New Perspectives on the Electronic Structure of Molecules and Chemical Bonds. Journal of Physical Chemistry A. pp. 2021-2050. ISSN 1089-5639

Cooper, David L., Ponec, Robert and Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 (2021) Investigating István Mayer’s “improved” definitions of bond orders and free valence for correlated singlet-state wave functions. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. e26612. ISSN 0020-7608

Silalahi, Imelda Hotmarisi, Heyam, Alexander Peter, Goult, Christopher et al. (3 more authors) (2020) Nuclear Magnetic Resonance and Computational Study of trans-µ2:η2, η2-1,3-butadiene-bis(trichloroplatinate(II)). Organometallics. pp. 4723-4734. ISSN 0276-7333

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804, Di, Make and Cooper, David L. (2020) Excited-state Aromaticity Reversals in Möbius Annulenes. Journal of Physical Chemistry A. pp. 9611-9616. ISSN 1089-5639

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 (2020) Norcorrole : Aromaticity and Antiaromaticity in Contest. Organic Letters. pp. 8676-8680. ISSN 1523-7060

Ponec, Robert, Cooper, David L. and Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 (2020) Are multicentre bond indices and related quantities reliable predictors of excited-state aromaticity? MOLECULES. 4791. ISSN 1420-3049

Lampkin, Bryan, Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 and VanVeller, Brett (2020) Detailed Visualization of Aromaticity Using Isotropic Magnetic Shielding. Angewandte Chemie International Edition. pp. 19275-19281. ISSN 1433-7851

Kotani, Ryota, Liu, Li, Kumar, Pardeep et al. (6 more authors) (2020) Controlling the S1 Energy Profile by Tuning Excited-State Aromaticity. Journal of the American Chemical Society. 14985–14992. ISSN 0002-7863

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 and Saito, Shohei (2020) Can Anti-Aufbau DFT Calculations Estimate Singlet Excited State Aromaticity? : Correspondence on “Dibenzoarsepins: Planarization of 8π‐Electron System in the Lowest Singlet Excited State”. Angewandte Chemie International Edition. pp. 9228-9230. ISSN 1433-7851

Lampkin, Bryan, Nguyen, Yen, Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 et al. (1 more author) (2019) Demonstration of Baird's rule complementarity in the singlet state with implications for excited-state intramolecular proton transfer. Physical Chemistry Chemical Physics. pp. 11608-11614. ISSN 1463-9084

Reid, Joshua Elias Samuel James, Aquino, Pedro H. G., Walker, Adam J. et al. (2 more authors) (2019) Statistical thermodynamics unveils how ions influence an aqueous Diels-Alder reaction. ChemPhysChem. ISSN 1439-4235

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804, Al-Yassiri, Muntadar Abd Al-Barri Hussain and Cooper, David L. (2018) Magnetic Shielding, Aromaticity, Antiaromaticity and Bonding in the Low-Lying Electronic States of S2N2. Chemistry : A European Journal. pp. 16791-16803. ISSN 1521-3765

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 and Cooper, David L. (2018) Does the Electronic Structure of Möbius Annulenes Follow Heilbronner’s Ideas? ChemPhysChem. pp. 3186-3190. ISSN 1439-4235

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 and Kirsopp, Josh John Mellor (2017) Magnetic Shielding Studies of C2 and C2H2 Support Higher than Triple Bond Multiplicity in C2. Chemistry : A European Journal. pp. 12949-12954. ISSN 1521-3765

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 and Cooper, David (2017) Modern Valence-Bond Descriptions of Polycyclic Fused Aromatic Compounds Involving Cyclopropenyl Rings. Computational and Theoretical Chemistry. ISSN 2210-271X

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804, Hearnshaw, Peter and Horner, Kate Elizabeth (2016) Magnetic Shielding, Aromaticity, Antiaromaticity and Bonding in the Low-Lying Electronic States of Benzene and Cyclobutadiene. Journal of Organic Chemistry. pp. 11346-11352. ISSN 1520-6904

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 and Cooper, David L. (2016) Modern Valence-Bond Description of Homoaromaticity. Journal of Physical Chemistry A. pp. 8769-8779. ISSN 1089-5639

Karadakov, Peter Borislavov orcid.org/0000-0002-2673-6804 and Horner, Kate Elizabeth (2016) Exploring Chemical Bonds through Variations in Magnetic Shielding. Journal of chemical theory and computation. pp. 558-563. ISSN 1549-9618

This list was generated on Sat Apr 17 18:08:54 2021 BST.