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Results for QTAIM

Publications & Outputs

  1. Decomposition of d- and f-shell contributions to uranium bonding from the quantum theory of atoms in molecules: Application to uranium and uranyl halides

    Tanti, J., Lincoln, M. & Kerridge, A., 30/08/2018, In: Inorganics. 6, 3, 19 p., 88.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  2. Advancing solvent extraction technology for improved management of contaminated liquors

    Fryer-Kanssen, I., 2017, Lancaster University. 149 p.

    Research output: Thesis › Doctoral Thesis

  3. Should environmental effects be included when performing QTAIM calculations on actinide systems? a comparison of QTAIM metrics for Cs2UO2Cl4, U(Se2PPh2)4 and Np(Se2PPh2)4 in gas phase, COSMO and PEECM

    Wellington, J. P. W., Kerridge, A. & Kaltsoyannis, N., 25/09/2016, In: Polyhedron. 116, p. 57-63 7 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review

  4. Assessing covalency in Cerium and Uranium hexachlorides: a correlated wavefunction and density functional theory study

    Beekmeyer, R. & Kerridge, A., 9/11/2015, In: Inorganics. 3, 4, p. 482-499 18 p.

    Research output: Contribution to Journal/Magazine › Journal article › peer-review