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Publication DateTitleAuthor(s)Date Added
12005Phase Measurement for Accurate Mapping of Chemical Bonds in Acentric Space GroupsSpackman, MA; Jiang, B; Groy, TL; He, H; Whitten, Andrew; Spence, JCH21-May-2009
22001Spectral density functions for quadrupolar nuclear spin relaxation due to translational diffusionSholl, C21-Jul-2008
32006Theory for nucleation at an interface and magnetization reversal of a two-layer nanowireLoxley, Peter ; Stamps, Robert L1-Jun-2017
42006Effective molecular polarizabilities and crystal refractive indices estimated from x-ray diffraction dataWhitten, Andrew; Jayatilaka, D; Spackman, MA15-May-2009
52006Electric field-derived point charges to mimic the electrostatics in molecular crystalsWhitten, Andrew; McKinnon, JJ; Spackman, MA1-May-2009
62006Dipole and quadrupole moments of molecules in crystals: A novel approach based on integration over Hirshfeld surfacesWhitten, Andrew; Radford, CJ; McKinnon, JJ; Spackman, MA15-May-2009
72001Theory of Domain Wall Nucleation in a Two Section Magnetic WireLoxley, Peter ; Stamps, R L1-Jun-2017
82008Rate of magnetization reversal due to nucleation of soliton-antisoliton pairs at point-like defectsLoxley, Peter 1-Jun-2017
92002A graphical technique for finding equilibrium magnetic domain walls in multilayer nanowiresLoxley, Peter 1-Jun-2017
102006Anisotropic displacement parameters for H atoms using an ONIOM approachWhitten, Andrew; Spackman, MA1-May-2009