John H Harding

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C. Richard A. Catlowprofessor of ChemistryVerified email at ucl.ac.uk
Steve ParkerProfessor of Chemistry, University of BathVerified email at bath.ac.uk
Derek C SinclairUniversity of SheffieldVerified email at sheffield.ac.uk
James Alexander DawsonReader and Newcastle University Academic Track Fellow in Energy MaterialsVerified email at newcastle.ac.uk
Keith Tobias ButlerDepartment of Chemistry, University College LondonVerified email at ucl.ac.uk
Frederik ClaeyssensProfessor in Polymer Materials, Sheffield UniversityVerified email at sheffield.ac.uk
Anthony HarkerProfessor of Physics, UCLVerified email at ucl.ac.uk
David QuigleyProfessor, University of WarwickVerified email at warwick.ac.uk
Hungru ChenMurata ManufacturingVerified email at bath.ac.uk
Dean SayleEmeritus Reader, University of KentVerified email at kent.ac.uk
Riccardo Innocenti MaliniPost Doc, EMPAVerified email at empa.ch
Julian D GaleCurtin UniversityVerified email at curtin.edu.au
John PurtonSTFCVerified email at stfc.ac.uk
Karl P TravisReader of Computational Physics and Nuclear Waste Disposal, University of SheffieldVerified email at sheffield.ac.uk
John A. VenablesArizona State UniversityVerified email at asu.edu
Fiona MeldrumProfessor of Inorganic Chemistry, University of LeedsVerified email at leeds.ac.uk
James A. ElliottProfessor of Macromolecular Materials Science, University of CambridgeVerified email at cam.ac.uk
Julian DeanUniversity of sheffieldVerified email at sheffield.ac.uk
Boaz PokroyTechnion Israel Institute of TechnologyVerified email at technion.ac.il
Per Erik VullumSINTEF IndustryVerified email at sintef.no

John H Harding

Professor of Materials Simulation, University of Sheffield

Verified email at sheffield.ac.uk - Homepage

Atomistic simulation defects ceramics biomineralisation surfaces


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Graphitic nanofilms as precursors to wurtzite films: theory CL Freeman, F Claeyssens, NL Allan, JH Harding Physical review letters 96 (6), 066102, 2006	614	2006
Growth of ZnO thin films—experiment and theory F Claeyssens, CL Freeman, NL Allan, Y Sun, MNR Ashfold, JH Harding Journal of Materials Chemistry 15 (1), 139-148, 2005	436	2005
Dopant ion radius and ionic conductivity in cerium dioxide V Butler, CRA Catlow, BEF Fender, JH Harding Solid State Ionics 8 (2), 109-113, 1983	397	1983
The thermodynamics of calcite nucleation at organic interfaces: Classical vs. non-classical pathways Q Hu, MH Nielsen, CL Freeman, LM Hamm, J Tao, JRI Lee, TYJ Han, ... Faraday Discussions 159 (1), 509-523, 2012	243	2012
Tuning hardness in calcite by incorporation of amino acids YY Kim, JD Carloni, B Demarchi, D Sparks, DG Reid, ME Kunitake, ... Nature materials 15 (8), 903-910, 2016	234	2016
Protein sequences bound to mineral surfaces persist into deep time B Demarchi, S Hall, T Roncal-Herrero, CL Freeman, J Woolley, MK Crisp, ... elife 5, e17092, 2016	231	2016
Computer simulation of defects in ionic solids JH Harding Reports on Progress in Physics 53 (11), 1403, 1990	222	1990
Atomistic simulation of the dissociative adsorption of water on calcite surfaces S Kerisit, SC Parker, JH Harding The Journal of Physical Chemistry B 107 (31), 7676-7682, 2003	181	2003
Interface stability and the growth of optical quality perovskites on MgO RA McKee, FJ Walker, ED Specht, GE Jellison Jr, LA Boatner, JH Harding Physical review letters 72 (17), 2741, 1994	178	1994
The calculation of defect parameters in UO2 RA Jackson, AD Murray, JH Harding, CRA Catlow Philosophical Magazine A 53 (1), 27-50, 1986	175	1986
A recommendation for the thermal conductivity of UO2 JH Harding, DG Martin Journal of nuclear materials 166 (3), 223-226, 1989	168	1989
New forcefields for modeling biomineralization processes CL Freeman, JH Harding, DJ Cooke, JA Elliott, JS Lardge, DM Duffy The Journal of Physical Chemistry C 111 (32), 11943-11951, 2007	163	2007
Effects of cationic substitution on structural defects in layered cathode materials LiNiO 2 H Chen, JA Dawson, JH Harding Journal of Materials Chemistry A 2 (21), 7988-7996, 2014	162	2014
Lithium intercalation into vanadium pentoxide: a theoretical study JS Braithwaite, CRA Catlow, JD Gale, JH Harding Chemistry of materials 11 (8), 1990-1998, 1999	160	1999
Computational techniques at the organic− inorganic interface in biomineralization JH Harding, DM Duffy, ML Sushko, PM Rodger, D Quigley, JA Elliott Chemical reviews 108 (11), 4823-4854, 2008	139	2008
Hartree-Fock cluster computations of defect and perfect ionic crystal properties JH Harding, AH Harker, PB Keegstra, R Pandey, JM Vail, C Woodward Physica B+ C 131 (1-3), 151-156, 1985	136	1985
Structural control of crystal nuclei by an eggshell protein CL Freeman, JH Harding, D Quigley, PM Rodger Angewandte Chemie 30 (122), 5261-5263, 2010	130	2010
Biological control on calcite crystallization by polysaccharides M Yang, SLS Stipp, J Harding Crystal Growth and Design 8 (11), 4066-4074, 2008	129	2008
The surface structure of CeO2 (0 0 1) single crystals studied by elevated temperature STM H Nörenberg, JH Harding Surface science 477 (1), 17-24, 2001	126	2001
Atomistic modelling of the metal/oxide interface with image interactions DM Duffy, JH Harding, AM Stoneham Acta metallurgica et materialia 40, S11-S16, 1992	123	1992

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