Items Authored or Edited by Elaine Moore

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Number of items: 26.

Moore, Elaine Ann (2013). Computational modelling of inorganic Solids. Annual Reports on Progress of Chemistry. Section A: Inorganic Chemistry, 109 (In Press).

Moore, Elaine Ann (2012). Computational modelling of inorganic solids. Anual Reports on the Progress of Chemistry, Section A, Inorganic Chemistry, 108(1) pp. 449–463.

Widatallah, H. M.; Moore, E. A,; Babo, A. A.; Al-Barwani, M. S. and Elzain, M. (2012). Atomistic simulation and ab initio study of the defect structure of spinel-related Li_0.5-0.5xMg_xFe_2-0.5xO₄. Materials Research Bulletin, 47(12) pp. 3995–4000.

Widatallah, H. M.; Al-Harthi, S. H.; Johnson, C.; Klencsár, Z.; Gimelseed, A. M.; Moore, E. A. ; Al-Rawas, A. D.; Wynter, C. I. and Brown, D. E. (2011). Formation, cationic site exchange and surface structure of mechanosynthesized EuCrO₃ nanocrystalline particles. Journal of Physics D: Applied Physics, 44(26)

Berry, Frank J.; Coomer, Fiona C.; Hancock, Cathryn; Helgason, Őrn; Moore, Elaine A.; Slater, Peter R.; Wright, Adrian J. and Thomas, Michael F. (2011). Structure and magnetic properties of the cubic oxide fluoride BaFeO₂F. Journal of Solid State Chemistry, 184(6) pp. 1361–1366.

Moore, Elaine (2011). Computational modelling of inorganic solids. Annual Reports in the Progress of Chemistry; Section A, 107

Berry, Frank J.; Bowfield, Andrew F.; Coomer, Fiona C.; Jackson, Simon D.; Moore, Elaine A.; Slater, Peter R.; Thomas, Michael F.; Wrtght, Adrian J. and Ren, Xiaolin (2009). Fluorination of perovskite-related phases of composition SrFe1-xSnxO3-delta. Journal of Physics: Condensed Matter, 21(25) p. 256001.

Widatallah, H. M.; Al-Rawas, A. D.; Johnson, C.; Al-Harthi, S. H.; Gismelseed, A. M.; Moore, E. A. and Stewart, S. J. (2009). The Formation of Nanocrystalline SrFeO3−δ Using Mechano-Synthesis and Subsequent Sintering: Structural and Mössbauer Studies. Journal of Nanoscience and Nanotechnology, 9(4) p. 2510.

Berry, F. J.; Lyubutin, I. S.; Moore, E. A.; Thomas, M. F. and Dmitrieva, T. V. (2009). Magnetic order in tin-doped thiospinels. Materials Chemistry and Physics, 113(2-3) pp. 714–716.

Berry, Frank J.; Moore, Elaine; Mortimer, Michael; Ren, Xiaolin; Heap, Richard; Slater, Peter and Thomas, Michael F. (2008). Synthesis and structural investigation of a new oxide fluoride of composition Ba2SnO2.5F3·xH2O (x≈0.5). Journal of Solid State Chemistry, 181(9) pp. 2185–2190.

Moore, Elaine (2008). Computational modelling of inorganic solids. Annual Reports on the Progress of Chemistry, Section A: Inorganic Chemistry, 104 pp. 46–63.

Berry, F. J.; Heap, R.; Helgason, O.; Moore, E. A.; Shim, S.; Slater, P. R. and Thomas, M. F. (2008). Magnetic order in perovskite-related SrFeO2F. Journal of Physics: Condensed Matter, 20(21) pp. 215207–215212.

Berry, F. J.; Moore, E. A.; Ren, X.; Helgason, Ö.; Thomas, M. F. and Shim, S. (2008). Iron-57 Mössbauer spectroscopic study of fluorinated strontium orthoferrite. Hyperfine Interactions, 185(1-3) pp. 111–114.

Moore, Elaine (2007). First-principles study of the mixed oxide alpha-FeCrO3. Physical Review B, 76(19) p. 195107.

Moore, Elaine and Widatallah, Hisham (2007). Iron(III) as a defect in diantimony tetroxide. Materials Research Bulletin, 43(8-9) pp. 2361–2367.

Johnson, Clive; Moore, Elaine A. and Mortimer, Michael (2005). Periodic ab initio calculation of nuclear quadrupole parameters as an assignment tool in solid state NMR spectroscopy: applications to ²³Na NMR spectra of crystalline materials. Solid State Nuclear Magnetic Resonance, 27(3) pp. 155–164.

Widatallah, H.M. and Moore, E.A. (2004). Defect clusters in titanium-substituted spinel-related lithium ferrite. Journal of Physics and Chemistry of Solids, 65(10) pp. 1663–1667.

Berry, Frank; Helgason, Om; Moore, Elaine; Mosselmans, Frederick and Ren, Xiaolin (2004). The Magnetic hyperfine field in tin-doped Fe3O4: variations during oxidation and subsequent phase transformations. Journal of Physics: Condensed Matter, 16(28) pp. 5119–5128.

Berry, Frank; Bohorquez, A; Helgason, O; Jiang, J; Marco, J; Moore, Elaine and Morup, S (2003). Nanocrystalline Oxides and Sulphides prepared by Hydrothermal Processing and Mechanical Milling. In: Mashlan, Miroslav; Miglierini, Marcel and Schaaf, Peter eds. Material Research in Atomic Scale by Mossbauer Spectroscopy. NATO Science Series II: Mathematics, Physics and Chemistry (94). Netherlands: Springer, pp. 1–10.

Moore, Elaine (2002). Ab initio calculations of Co shielding in model complexes. International Journal of Molecular Sciences, 3(8) pp. 873–887.

Ayub, Ibrar; Berry, Frank J.; Johnson, Clive; Johnson, David A.; Moore, Elaine A.; Ren, Xiaolin and Widatallah, Hisham M. (2002). Tin-, titanium-, and magnesium-doped alpha-Cr2O3: characterisation and rationalisation of the structures. Solid State Communications, 123(3-4) pp. 141–145.

Moore, Elaine A.; Widatallah, Hisham M. and Berry, Frank J. (2002). Prediction of defect structure in lithiated tin- and titanium-doped alpha-Fe2O3 using atomistic simulation. Journal of Physics and Chemistry of Solids, 63(3) pp. 519–523.

Moore, Elaine A. and Mason, Joan (2002). 15N NMR shielding tensors in bent nitrosyl complexes of cobalt. Journal of Molecular Structure, 602 - 603 pp. 347–356.

Mason, Joan; Larkworthy, Leslie and Moore, Elaine (2002). Nitrogen NMR spectroscopy of metal nitrosyls and related compounds. Chemical Reviews, 102(4) pp. 913–934.

Moore, Elaine; Bohorquez, A.; Berry, Frank; Helgason, O. and Marco, J.F. (2001). Investigation of defect structures formed by doping tetravalent ions into spinel-related iron oxides using atomistic simulation calculations. Journal of Physics and Chemistry of Solids, 62 pp. 1277–1284.

Ayub, Ibrar; Berry, Frank J.; Bilsborrow, Robert L.; Helgason, Orn; Mercader, Roberto C.; Moore, Elaine A.; Stewart, Silvana J. and Wynn, Paul G. (2001). Influence of zinc doping on the structural and magnetic properties of alpha-Fe2O3. Journal of Solid State Chemistry, 156(2) pp. 408–414.

This list was generated on Fri May 24 22:40:12 2013 BST.

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