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
Keith Tobias ButlerDepartment of Chemistry, University College LondonVerified email at ucl.ac.uk
James Alexander DawsonReader and Newcastle University Academic Track Fellow in Energy MaterialsVerified email at newcastle.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
Julian D GaleCurtin UniversityVerified email at curtin.edu.au
John PurtonSTFCVerified email at stfc.ac.uk
Riccardo Innocenti MaliniPost Doc, EMPAVerified email at empa.ch
John A. VenablesArizona State UniversityVerified email at asu.edu
Karl P TravisReader of Computational Physics and Nuclear Waste Disposal, University of SheffieldVerified email at sheffield.ac.uk
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	596	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	421	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	393	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	222	2012
Computer simulation of defects in ionic solids JH Harding Reports on Progress in Physics 53 (11), 1403, 1990	221	1990
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	200	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	199	2016
The calculation of defect parameters in UO2 RA Jackson, AD Murray, JH Harding, CRA Catlow Philosophical Magazine A 53 (1), 27-50, 1986	184	1986
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	177	1994
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	173	2003
A recommendation for the thermal conductivity of UO2 JH Harding, DG Martin Journal of nuclear materials 166 (3), 223-226, 1989	164	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	159	2007
Lithium intercalation into vanadium pentoxide: a theoretical study JS Braithwaite, CRA Catlow, JD Gale, JH Harding Chemistry of materials 11 (8), 1990-1998, 1999	159	1999
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	144	2014
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	136	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	134	1985
Biological control on calcite crystallization by polysaccharides M Yang, SLS Stipp, J Harding Crystal Growth and Design 8 (11), 4066-4074, 2008	130	2008
Structural control of crystal nuclei by an eggshell protein CL Freeman, JH Harding, D Quigley, PM Rodger Angewandte Chemie International Edition 49 (30), 5135-5137, 2010	125	2010
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	123	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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