Peter B. Karadakov
Affiliations: | Chemistry | University of York, York, England, United Kingdom |
Area:
molecular electronic structure theoryWebsite:
http://www-users.york.ac.uk/~pbk1/Google:
"Peter B Karadakov"Mean distance: 10.65
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Publications
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| Karadakov PB, Preston N. (2021) Aromaticity reversals and their effect on bonding in the low-lying electronic states of cyclooctatetraene. Physical Chemistry Chemical Physics : Pccp. 23: 24750-24756 |
| Penotti FE, Cooper DL, Karadakov PB. (2021) Role of Dynamical Electron Correlation in the Differences in Bonding between CaAlH and MgAlH. The Journal of Physical Chemistry. A. 125: 3912-3919 |
| Dunning TH, Xu LT, Cooper DL, et al. (2021) Spin-Coupled Generalized Valence Bond Theory: New Perspectves on the Electronic Structure of Molecules and Chemical Bonds. The Journal of Physical Chemistry. A |
| Lampkin BJ, Karadakov PB, VanVeller B. (2020) Detailed Visualization of Aromaticity Using Isotropic Magnetic Shielding. Angewandte Chemie (International Ed. in English). 59: 19275-19281 |
| Karadakov PB, Saito S. (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 Ed. in English). 59: 9228-9230 |
| Penotti FE, Cooper DL, Karadakov PB, et al. (2020) Nature of the chemical bonding in D3h [MH3M]+ cations (M = Be, Mg) International Journal of Quantum Chemistry. 120 |
| Lampkin BJ, Nguyen YH, Karadakov PB, et al. (2019) Demonstration of Baird's rule complementarity in the singlet state with implications for excited-state intramolecular proton transfer. Physical Chemistry Chemical Physics : Pccp |
| Karadakov PB, Cooper DL. (2018) Does the Electronic Structure of Möbius Annulenes Follow Heilbronner's Ideas? Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry |
| Karadakov PB, Al-Yassiri M, Cooper DL. (2018) Magnetic Shielding, Aromaticity, Antiaromaticity and Bonding in the Low-Lying Electronic States of S2N2. Chemistry (Weinheim An Der Bergstrasse, Germany) |
| Penotti FE, Cooper DL, Karadakov PB. (2018) Is the S2N2 ring a singlet diradical? Critical analysis of alternative valence bond descriptions International Journal of Quantum Chemistry. 119 |