Paul D Bristowe - Publications

Affiliations: 
University of Cambridge, Cambridge, England, United Kingdom 
 Clare College, Cambridge 
Area:
Computational materials science
Website:
https://www.clare.cam.ac.uk/Fellows-and-Staff-Directory/pdb1000/

125 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2021 Dai LJ, Deng ZY, Auras F, Goodwin H, Zhang ZL, Walmsley JC, Bristowe PD, Deschler F, Greenham NC. Slow carrier relaxation in tin-based perovskite nanocrystals Nature Photonics. 15: 696-702. DOI: 10.1038/s41566-021-00847-2  0.273
2019 Wei F, Deng Z, Sun S, Hartono NTP, Seng HL, Buonassisi T, Bristowe PD, Cheetham AK. Enhanced visible light absorption for lead-free double perovskite CsAgSbBr. Chemical Communications (Cambridge, England). PMID 30869691 DOI: 10.1039/C9Cc01134J  0.752
2019 Evans HA, Deng Z, Collings IE, Wu Y, Andrews JL, Pilar K, Tuffnell JM, Wu G, Wang J, Dutton SE, Bristowe PD, Seshadri R, Cheetham AK. Polymorphism in M(HPO) (M = V, Al, Ga) compounds with the perovskite-related ReO structure. Chemical Communications (Cambridge, England). PMID 30778470 DOI: 10.1039/C9Cc00118B  0.723
2019 Dawson I, Bristowe PD, Lee M, Payne MC, Segall MD, White JA. First-principles study of a tilt grain boundary in rutile. Physical Review. B, Condensed Matter. 54: 13727-13733. PMID 9985288 DOI: 10.1103/Physrevb.54.13727  0.536
2018 Milowska KZ, Burda M, Wolanicka L, Bristowe PD, Koziol KKK. Carbon nanotube functionalization as a route to enhancing the electrical and mechanical properties of Cu-CNT composites. Nanoscale. 11: 145-157. PMID 30525144 DOI: 10.1039/C8Nr07521B  0.407
2018 Furnival T, Knez D, Schmidt E, Leary RK, Kothleitner G, Hofer F, Bristowe PD, Midgley PA. Adatom dynamics and the surface reconstruction of Si(110) revealed using time-resolved electron microscopy Applied Physics Letters. 113: 183104. DOI: 10.1063/1.5052729  0.744
2018 Wang T, Bristowe PD. A predictive modeling study of the impact of chemical doping on the strength of a Ag/ZnO interface Journal of Applied Physics. 124: 235304. DOI: 10.1063/1.5051987  0.608
2018 Deng Z, Kieslich G, Bristowe PD, Cheetham AK, Sun S. Octahedral connectivity and its role in determining the phase stabilities and electronic structures of low-dimensional, perovskite-related iodoplumbates Apl Materials. 6: 114202. DOI: 10.1063/1.5046404  0.699
2018 Lee J, Deng Z, Bristowe NC, Bristowe PD, Cheetham AK. The competition between mechanical stability and charge carrier mobility in MA-based hybrid perovskites: insight from DFT Journal of Materials Chemistry C. 6: 12252-12259. DOI: 10.1039/C8Tc04750B  0.689
2018 Wei F, Brivio F, Wu Y, Sun S, Bristowe PD, Cheetham AK. Synthesis, crystal structure, magnetic and electronic properties of the caesium-based transition metal halide Cs3Fe2Br9 Journal of Materials Chemistry C. 6: 3573-3577. DOI: 10.1039/C7Tc04798C  0.63
2018 Schmidt E, Fowler A, Elliott JA, Bristowe PD. Learning models for electron densities with Bayesian regression Computational Materials Science. 149: 250-258. DOI: 10.1016/J.Commatsci.2018.03.029  0.557
2018 Hoye RLZ, Eyre L, Wei F, Brivio F, Sadhanala A, Sun S, Li W, Zhang KHL, MacManus-Driscoll JL, Bristowe PD, Friend RH, Cheetham AK, Deschler F. Fundamental Carrier Lifetime Exceeding 1 µs in Cs2AgBiBr6Double Perovskite Advanced Materials Interfaces. 5: 1800464. DOI: 10.1002/Admi.201800464  0.308
2017 Wu Y, Shaker SM, Brivio F, Murugavel R, Bristowe PD, Cheetham AK. [Am]Mn(H2POO)3: a new family of hybrid perovskites based on the hypophosphite ligand. Journal of the American Chemical Society. PMID 29069898 DOI: 10.1021/Jacs.7B09417  0.59
2017 Deng Z, Wei F, Brivio F, Wu Y, Sun S, Bristowe PD, Cheetham AK. The Synthesis and Characterization of the Rare-Earth Hybrid Double Perovskites: (CH3NH3)2KGdCl6 and (CH3NH3)2KYCl6. The Journal of Physical Chemistry Letters. PMID 28952733 DOI: 10.1021/Acs.Jpclett.7B02322  0.748
2017 Shah SH, Bristowe PD. Point defect formation in M2AlC (M = Zr,Cr) MAX phases and their tendency to disorder and amorphize. Scientific Reports. 7: 9667. PMID 28852165 DOI: 10.1038/S41598-017-10273-6  0.329
2017 Sun S, Isikgor FH, Deng Z, Wei F, Kieslich G, Bristowe PD, Ouyang J, Cheetham AK. Factors influencing the mechanical properties of formamidinium lead halides and related hybrid perovskites. Chemsuschem. PMID 28666079 DOI: 10.1002/Cssc.201700991  0.76
2017 Sun S, Deng Z, Wu Y, Wei F, Halis Isikgor F, Brivio F, Gaultois MW, Ouyang J, Bristowe PD, Cheetham AK, Kieslich G. Variable temperature and high-pressure crystal chemistry of perovskite formamidinium lead iodide: a single crystal X-ray diffraction and computational study. Chemical Communications (Cambridge, England). PMID 28632277 DOI: 10.1039/C7Cc00995J  0.735
2017 Milowska KZ, Ghorbani-Asl M, Burda M, Wolanicka L, Ćatić N, Bristowe PD, Koziol KKK. Breaking the electrical barrier between copper and carbon nanotubes. Nanoscale. 9: 8458-8469. PMID 28604888 DOI: 10.1039/C7Nr02142A  0.308
2017 Janas D, Milowska KZ, Bristowe PD, Koziol KK. Improving the electrical properties of carbon nanotubes with interhalogen compounds. Nanoscale. 9: 3212-3221. PMID 28221390 DOI: 10.1039/C7Nr00224F  0.38
2017 Schmidt E, Bristowe PD. Identifying early stage precipitation in large-scale atomistic simulations of superalloys Modelling and Simulation in Materials Science and Engineering. 25: 35005. DOI: 10.1088/1361-651X/Aa5C53  0.45
2017 Wei F, Deng Z, Sun S, Zhang F, Evans DM, Kieslich G, Tominaka S, Carpenter MA, Zhang J, Bristowe PD, Cheetham AK. Synthesis and Properties of a Lead-Free Hybrid Double Perovskite: (CH3NH3)2AgBiBr6 Chemistry of Materials. 29: 1089-1094. DOI: 10.1021/Acs.Chemmater.6B03944  0.773
2017 Furnival T, Leary RK, Tyo EC, Vajda S, Ramasse QM, Thomas JM, Bristowe PD, Midgley PA. Anomalous diffusion of single metal atoms on a graphene oxide support Chemical Physics Letters. 683: 370-374. DOI: 10.1016/J.Cplett.2017.04.071  0.75
2017 Wang T, Bristowe PD. Controlling Ag diffusion in ZnO by donor doping: A first principles study Acta Materialia. 137: 115-122. DOI: 10.1016/J.Actamat.2017.07.024  0.609
2017 Sun S, Isikgor FH, Deng Z, Wei F, Kieslich G, Bristowe PD, Ouyang J, Cheetham AK. Front Cover: Factors Influencing the Mechanical Properties of Formamidinium Lead Halides and Related Hybrid Perovskites (ChemSusChem 19/2017) Chemsuschem. 10: 3680-3680. DOI: 10.1002/Cssc.201701761  0.738
2016 Muñoz Ramo D, Bristowe PD. Impact of amorphization on the electronic properties of Zn-Ir-O systems. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 28: 345502. PMID 27357345 DOI: 10.1088/0953-8984/28/34/345502  0.451
2016 Sun S, Tominaka S, Lee JH, Xie F, Bristowe PD, Cheetham AK. Synthesis, crystal structure, and properties of a perovskite-related bismuth phase, (NH4)3Bi2I9 Apl Materials. 4. DOI: 10.1063/1.4943680  0.633
2016 Deng Z, Wei F, Sun S, Kieslich G, Cheetham AK, Bristowe PD. Exploring the properties of lead-free hybrid double perovskites using a combined computational-experimental approach Journal of Materials Chemistry A. 4: 12025-12029. DOI: 10.1039/C6Ta05817E  0.754
2016 Wei F, Deng Z, Sun S, Xie F, Kieslich G, Evans DM, Carpenter MA, Bristowe PD, Cheetham AK. The synthesis, structure and electronic properties of a lead-free hybrid inorganic-organic double perovskite (MA)2KBiCl6 (MA = methylammonium) Materials Horizons. 3: 328-332. DOI: 10.1039/C6Mh00053C  0.755
2016 Bajpe SR, Henke S, Lee J, Bristowe PD, Cheetham AK. Disorder and polymorphism in Cu(ii)-polyoxometalate complexes: [Cu1.5(H2O)7.5PW12O40]·4.75H2O, cis- & trans-[Cu2(H2O)10SiW12O40]·6H2O Crystengcomm. 18: 5327-5332. DOI: 10.1039/C5Ce02088C  0.578
2016 Lee J, Bristowe NC, Lee JH, Lee S, Bristowe PD, Cheetham AK, Jang HM. Resolving the Physical Origin of Octahedral Tilting in Halide Perovskites Chemistry of Materials. 28: 4259-4266. DOI: 10.1021/Acs.Chemmater.6B00968  0.616
2015 Lee JH, Bristowe NC, Bristowe PD, Cheetham AK. Role of hydrogen-bonding and its interplay with octahedral tilting in CH3NH3PbI3. Chemical Communications (Cambridge, England). 51: 6434-7. PMID 25766075 DOI: 10.1039/C5Cc00979K  0.591
2014 Muñoz Ramo D, Bristowe PD. The effect of defects and disorder on the electronic properties of ZnIr2O4. The Journal of Chemical Physics. 141: 084704. PMID 25173027 DOI: 10.1063/1.4893556  0.464
2014 Körner W, Urban DF, Ramo DM, Bristowe PD, Elsässer C. Prediction of subgap states in Zn- and Sn-based oxides using various exchange-correlation functionals Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.195142  0.339
2014 Jiang X, Zhao S, Lin Z, Luo J, Bristowe PD, Guan X, Chen C. The role of dipole moment in determining the nonlinear optical behavior of materials: ab initio studies on quaternary molybdenum tellurite crystals Journal of Materials Chemistry C. 2: 530-537. DOI: 10.1039/C3Tc31872A  0.328
2014 Ramo DM, Bristowe PD. Hybrid density functional calculations of the defect properties of ZnO:Rh and ZnO:Ir Thin Solid Films. 555: 112-116. DOI: 10.1016/J.Tsf.2013.08.013  0.398
2014 Ramo DM, Chroneos A, Rushton MJD, Bristowe PD. Effect of trivalent dopants on local coordination and electronic structure in crystalline and amorphous ZnO Thin Solid Films. 555: 117-121. DOI: 10.1016/J.Tsf.2013.05.140  0.397
2014 Eurich NC, Bristowe PD. Thermodynamic stability and electronic structure of η-Ni6Nb(Al,Ti) from first principles Scripta Materialia. 77: 37-40. DOI: 10.1016/J.Scriptamat.2014.01.012  0.353
2013 Chang BK, Bristowe PD, Cheetham AK. Computational studies on the adsorption of CO2 in the flexible perfluorinated metal-organic framework zinc 1,2-bis(4-pyridyl)ethane tetrafluoroterephthalate. Physical Chemistry Chemical Physics : Pccp. 15: 176-82. PMID 23147556 DOI: 10.1039/C2Cp43093B  0.708
2013 Zhang C, Bristowe PD. First principles calculations of oxygen vacancy formation in barium-strontium-cobalt-ferrite Rsc Advances. 3: 12267-12274. DOI: 10.1039/C3Ra41585F  0.338
2012 Chang BK, Bristowe NC, Bristowe PD, Cheetham AK. Van der Waals forces in the perfluorinated metal-organic framework zinc 1,2-bis(4-pyridyl)ethane tetrafluoroterephthalate. Physical Chemistry Chemical Physics : Pccp. PMID 22482115 DOI: 10.1039/C2Cp23530G  0.729
2012 Toda-Caraballo I, Bristowe PD, Capdevila C. A molecular dynamics study of grain boundary free energies, migration mechanisms and mobilities in a bcc Fe–20Cr alloy Acta Materialia. 60: 1116-1128. DOI: 10.1016/J.Actamat.2011.11.021  0.503
2011 Shah SH, Bristowe PD. Ab initio energetics of lanthanum substitution in ferroelectric bismuth titanate. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 23: 155902. PMID 21460424 DOI: 10.1088/0953-8984/23/15/155902  0.339
2011 Korner W, Bristowe P, Elsasser C. Density functional theory study of stoichiometric and nonstoichiometric ZnO grain boundaries Physical Review B. 84. DOI: 10.1103/Physrevb.84.045305  0.386
2011 Phillips CL, Bristowe PD. First principles study of ZnO adsorption on stressed metal surfaces Surface Science. 605: 450-455. DOI: 10.1016/J.Susc.2010.11.016  0.306
2008 Chappell H, Duer M, Groom N, Pickard C, Bristowe P. Probing the surface structure of hydroxyapatite using NMR spectroscopy and first principles calculations Physical Chemistry Chemical Physics. 10: 600-606. PMID 18183321 DOI: 10.1039/B714512H  0.739
2008 Phillips CL, Bristowe PD. First principles study of the adhesion asymmetry of a metal/oxide interface Journal of Materials Science. 43: 3960-3968. DOI: 10.1007/S10853-007-2137-1  0.315
2007 Chappell HF, Bristowe PD. Density functional calculations of the properties of silicon-substituted hydroxyapatite Journal of Materials Science: Materials in Medicine. 18: 829-837. PMID 17180707 DOI: 10.1007/S10856-006-0001-5  0.76
2007 Lin Z, Bristowe PD. Microscopic characteristics of the Ag(111)/ZnO(0001) interface present in optical coatings Physical Review B. 75: 205423. DOI: 10.1103/Physrevb.75.205423  0.309
2007 Lin Z, Bristowe PD. A density functional study of the effect of hydrogen on the strength of an epitaxial Ag/ZnO interface Journal of Applied Physics. 102: 103513. DOI: 10.1063/1.2815646  0.301
2006 Pezold Jv, Bristowe PD. Metal (Ni, Au)-vacancy complexes in GaN Physica Status Solidi (C). 3: 1783-1786. DOI: 10.1002/Pssc.200565309  0.345
2005 Bristowe PD. Theory and modelling of ferroelectric materials Current Opinion in Solid State & Materials Science. 9: 99-99. DOI: 10.1016/J.Cossms.2006.06.004  0.345
2005 Pezold Jv, Bristowe PD. Atomic structure and electronic properties of the GaN/ZnO (0001) interface Journal of Materials Science. 40: 3051-3057. DOI: 10.1007/S10853-005-2664-6  0.351
2004 Astala RK, Bristowe PD. Ab initio calculations of doping mechanisms in SrTiO3 Modelling and Simulation in Materials Science and Engineering. 12: 79-90. DOI: 10.1088/0965-0393/12/1/008  0.347
2004 Domingos H, Carlsson J, Bristowe P, Hellsing B. The Formation of Defect Complexes in a ZnO Grain Boundary Interface Science. 12: 227-234. DOI: 10.1023/B:Ints.0000028652.75962.10  0.738
2003 Carlsson JM, Domingos HS, Bristowe PD, Hellsing B. An interfacial complex in ZnO and its influence on charge transport. Physical Review Letters. 91: 165506. PMID 14611415 DOI: 10.1103/Physrevlett.91.165506  0.725
2003 Domingos HS, Bristowe PD. On the stability of Met-Car analogue clusters in the solid state Journal of Physics: Condensed Matter. 15: 4341-4348. DOI: 10.1088/0953-8984/15/25/305  0.708
2003 Carlsson JM, Hellsing B, Domingos HS, Bristowe PD. The effects of doping a grain boundary in ZnO with various concentrations of Bi Surface Science. 532: 351-358. DOI: 10.1016/S0039-6028(03)00193-6  0.433
2002 Astala RK, Bristowe PD. The Properties of a Na-Doped Twist Boundary in SrTiO 3 from First Principles Mrs Proceedings. 751. DOI: 10.1557/Proc-751-Z3.23  0.43
2002 Carlsson JM, Hellsing B, Domingos HS, Bristowe PD. Theoretical investigation of the pure and Zn-dopedαandδphases ofBi2O3 Physical Review B. 65. DOI: 10.1103/Physrevb.65.205122  0.705
2002 Astala R, Bristowe PD. First principles calculations of niobium substitution in strontium titanate Journal of Physics: Condensed Matter. 14. DOI: 10.1088/0953-8984/14/6/103  0.382
2002 Astala R, Bristowe PD. A computational study of twist boundary structures in strontium titanate Journal of Physics: Condensed Matter. 14: 13635-13641. DOI: 10.1088/0953-8984/14/49/317  0.454
2002 Domingos HS, Carlsson JM, Bristowe PD, Hellsing B. Charge accumulation and barrier formation at grain boundaries in ZnO decorated with bismuth Journal of Physics: Condensed Matter. 14: 12717-12724. DOI: 10.1088/0953-8984/14/48/308  0.76
2001 Astala R, Bristowe PD. Ab initio study of the oxygen vacancy in SrTiO3 Modelling and Simulation in Materials Science and Engineering. 9: 415-422. DOI: 10.1088/0965-0393/9/5/306  0.329
2001 Chisholm JA, Bristowe PD. The electrical activity of GaN doped with transition metal impurities Modelling and Simulation in Materials Science and Engineering. 9: 249-258. DOI: 10.1088/0965-0393/9/4/301  0.361
2001 Carlsson JM, Hellsing B, Domingos HS, Bristowe PD. Electronic properties of a grain boundary in Sb-doped ZnO Journal of Physics: Condensed Matter. 13: 9937-9943. DOI: 10.1088/0953-8984/13/44/309  0.76
2001 Chisholm JA, Bristowe PD. Computational study of the effect of Al and In on the formation energies and acceptor levels of Mg and C dopants in GaN Journal of Physics Condensed Matter. 13: 8875-8880. DOI: 10.1088/0953-8984/13/40/301  0.323
2001 Domingos HS, Bristowe PD, Carlsson J, Hellsing B. Interface Science. 9: 231-235. DOI: 10.1023/A:1015102610444  0.754
2001 Astala R, Bristowe PD. Ab initio and classical simulations of defects in SrTiO3 Computational Materials Science. 22: 81-86. DOI: 10.1016/S0927-0256(01)00171-9  0.385
2001 Chisholm JA, Bristowe PD. Formation energies of metal impurities in GaN Computational Materials Science. 22: 73-77. DOI: 10.1016/S0927-0256(01)00168-9  0.342
2001 Domingos HS, Bristowe PD. Electronic structure of twist grain-boundaries in ZnO and the effect of Sb doping Computational Materials Science. 22: 38-43. DOI: 10.1016/S0927-0256(01)00162-8  0.767
2000 Bristowe PD, Domingos HS. Theoretical Investigations of Interfaces in Electroceramic Materials Advanced Engineering Materials. 2: 497-502. DOI: 10.1002/1527-2648(200008)2:8<497::Aid-Adem497>3.0.Co;2-X  0.742
1999 Chisholm JA, Bristowe PD. Simulations of defect-interface interactions in GaN Mrs Proceedings. 595. DOI: 10.1557/Proc-595-F99W3.72  0.378
1999 Chisholm JA, Lewis DW, Bristowe PD. Classical simulations of the properties of group-III nitrides Journal of Physics Condensed Matter. 11. DOI: 10.1088/0953-8984/11/22/102  0.331
1999 Harris RM, Bristowe PD. Computer modelling of slip in TiC Philosophical Magazine. 79: 705-721. DOI: 10.1080/01418619908210326  0.313
1999 Domingos H, Bristowe P. Atomistic simulation of grain boundary segregation in zinc oxide Scripta Materialia. 41: 1347-1352. DOI: 10.1016/S1359-6462(99)00278-X  0.717
1997 Dawson I, Bristowe PD, White JA, Payne MC. First principles computer simulation of the defect chemistry of rutile TiO2 Materials Research Society Symposium - Proceedings. 453: 203-208. DOI: 10.1557/Proc-453-203  0.328
1996 Dawson I, Bristowe PD, Payne MC, Lee MH. Ab initio investigation of a grain boundary in a transition metal oxide Materials Research Society Symposium - Proceedings. 408: 271-276. DOI: 10.1557/Proc-408-271  0.452
1994 Majid I, Counterman CA, Bristowe PD, Balluffi RW. X-ray diffraction and computer simulation studies of the structure of [001] twist boundaries in AuAg alloys Acta Metallurgica Et Materialia. 42: 3331-3340. DOI: 10.1016/0956-7151(94)90465-0  0.641
1994 Majid I, Counterman CA, Najafabadi R, Bristowe PD. X-ray diffraction and computer simulation studies on the structure of homophase and heterophase interfaces in metals Journal of Physics and Chemistry of Solids. 55: 1007-1015. DOI: 10.1016/0022-3697(94)90120-1  0.409
1993 Fernandes MG, Pontikis V, Bristowe PD. Molecular Statics Of A Ni/Zr Heterophase Interface Mrs Proceedings. 319: 39. DOI: 10.1557/Proc-319-39  0.379
1993 Lee W-, Bristowe PD, Solorzano IG, Vandersande JB. Atomistic Calculations and Hrtem Observations of an [001] Tilt Boundary in Rutile Mrs Proceedings. 319. DOI: 10.1557/Proc-319-239  0.426
1993 Lee W-, Bristowe PD, Gao Y, Merkle KL. The atomic structure of twin boundaries in rutile Philosophical Magazine Letters. 68: 309-314. DOI: 10.1080/09500839308242908  0.436
1992 Needels M, Rappe AM, Bristowe PD, Joannopoulos JD. Ab initio study of a grain boundary in gold. Physical Review. B, Condensed Matter. 46: 9768-9771. PMID 10002790 DOI: 10.1103/Physrevb.46.9768  0.563
1992 Majid I, Bristowe PD. An x-ray diffraction and computer simulation study of [111] twist boundaries in gold Philosophical Magazine. 66: 73-87. DOI: 10.1080/01418619208201514  0.422
1991 Counterman CA, Majid I, Bristowe PD, Balluffi RW. On The Study Of Grain Boundary Segregation Using X-Ray Diffraction And Computer Simulation Mrs Proceedings. 238: 499. DOI: 10.1557/Proc-238-499  0.361
1991 Bristowe PD. The sensitivity of diffraction profiles to grain boundary segregation Scripta Metallurgica Et Materialia. 25: 79-84. DOI: 10.1016/0956-716X(91)90357-7  0.509
1990 Tarnow E, Dallot P, Bristowe PD, Joannopoulos JD, Francis GP, Payne MC. Structural complexity in grain boundaries with covalent bonding. Physical Review. B, Condensed Matter. 42: 3644-3657. PMID 9995879 DOI: 10.1103/Physrevb.42.3644  0.566
1990 Majid I, Wang D, Bristowe PD. Diffraction effects from (111) twist boundaries in gold Mrs Proceedings. 209. DOI: 10.2172/6152589  0.396
1990 Tarnow E, Arias T, Bristowe PD, Dallot P, Francis GP, Joannopoulos JD, Payne MC. The Relationship Between The Microscopic Properties Of Semiconducting Grain-Boundaries And Their Orientation Mrs Proceedings. 193. DOI: 10.1557/Proc-193-235  0.574
1990 Jhan R, Bristowe PD. A molecular dynamics study of grain boundary migration without the participation of secondary grain boundary dislocations Scripta Metallurgica Et Materialia. 24: 1313-1318. DOI: 10.1016/0956-716X(90)90348-K  0.389
1990 Wang D, Bristowe PD. Calculation of Diffraction Effects Due to Double Positioning in (111) Gold Bicrystals Physica Status Solidi B-Basic Solid State Physics. 161: 501-511. DOI: 10.1002/Pssb.2221610206  0.389
1989 Majid I, Bristowe PD, Balluffi RW. Structures of Physical Review. B, Condensed Matter. 40: 2779-2792. PMID 9992207 DOI: 10.1103/Physrevb.40.2779  0.745
1989 Taylor MS, Majid I, Bristowe PD, Balluffi RW. Structures of Physical Review. B, Condensed Matter. 40: 2772-2778. PMID 9992206 DOI: 10.1103/Physrevb.40.2772  0.765
1989 Tarnow E, Bristowe PD, Joannopoulos JD, Payne MC. Predicting the structure and energy of a grain boundary in germanium Journal of Physics: Condensed Matter. 1: 327-333. DOI: 10.1088/0953-8984/1/2/001  0.558
1989 Payne MC, Tarnow E, Bristowe PD, Joannopoulos JD. Ab Initio Materials Science and Engineering using the Molecular Dynamics Method for Total Energy Pseudopotential Calculations Molecular Simulation. 4: 79-94. DOI: 10.1080/08927028908021966  0.546
1989 Majid I, Bristowe PD, Balluffi RW. Evidence against the existence of strong diffuse x-ray scattering from gold twist boundaries at room temperature Scripta Metallurgica. 23: 1639-1644. DOI: 10.1016/0036-9748(89)90143-9  0.606
1988 Tarnow E, Bristowe PD, Joannopoulos JD, Payne MC. Ab-Initio Molecular Dynamics Approach to the Study of Grain Boundaries in Semiconductors Mrs Proceedings. 141. DOI: 10.1557/Proc-141-333  0.616
1988 Balluffi RW, Majid I, Bristowe PD. On the Determination of Grain Boundary Structure Using X-RAY Diffraction Mrs Proceedings. 138. DOI: 10.1557/Proc-138-457  0.395
1988 Payne MC, Bristowe PD, Joannopoulos JD. Ab-Initio Calculation Of The Microscopic Properties Of A Grain Boundary In Germanium Le Journal De Physique Colloques. 49. DOI: 10.1051/Jphyscol:1988512  0.607
1988 Schwartz D, Bristowe PD, Vitek V. Dislocation structure and energy of high angle [001] twist boundaries: A computer simulation study Acta Metallurgica. 36: 675-687. DOI: 10.1016/0001-6160(88)90101-0  0.497
1987 Payne MC, Bristowe PD, Joannopoulos JD. Ab initio determination of the structure of a grain boundary by simulated quenching. Physical Review Letters. 58: 1348-1351. PMID 10034408 DOI: 10.1103/Physrevlett.58.1348  0.63
1987 Majid I, Bristowe PD. Dynamical simulation of structural multiplicity in grain boundaries Scripta Metallurgica. 21: 1153-1157. DOI: 10.1016/0036-9748(87)90268-7  0.383
1986 Payne MC, Bristowe PD, Joannopoulos JD. Theoretical Investigation of Twist Boundaries in Germanium Mrs Proceedings. 77. DOI: 10.1557/Proc-77-205  0.621
1985 Balluffi RW, Bristowe PD, Babcock SE, Chan S, Kvam EP, Liu JS. ON COMPARISONS BETWEEN COMPUTED AND OBSERVED GRAIN BOUNDARY STRUCTURES AND PROPERTIES IN METALS Le Journal De Physique Colloques. 46: C4-267-C4-280. DOI: 10.1051/Jphyscol:1985430  0.525
1985 Bristowe PD, Balluffi RW. Structural Unit/Grain Boundary Dislocation Model For Twist Boundaries In Cubic Crystals Le Journal De Physique Colloques. 46. DOI: 10.1051/Jphyscol:1985419  0.425
1984 Balluffi RW, Bristowe PD. On the structural unit/grain boundary dislocation model for grain boundary structure Surface Science. 144: 28-43. DOI: 10.1016/0039-6028(84)90701-5  0.645
1984 Bristowe PD, Balluffi RW. Effect of secondary relaxations on diffraction from high-Σ [001] twist boundaries Surface Science. 144: 14-27. DOI: 10.1016/0039-6028(84)90700-3  0.646
1984 Balluffi RW, Bristowe PD. On the detection of expansion at large angle grain boundaries using electron diffraction Scripta Metallurgica. 18: 617-620. DOI: 10.1016/0036-9748(84)90352-1  0.633
1983 Budai J, Bristowe PD, Sass SL. The projected atomic structure of a large angle [001]Σ = 5 (θ = 36.9°) twist boundary in gold: Diffraction analysis and theoretical predictions Acta Metallurgica. 31: 699-712. DOI: 10.1016/0001-6160(83)90085-8  0.409
1982 Bristowe PD. Computer Modeling Of Grain Boundaries In Cubic Metals Le Journal De Physique Colloques. 43. DOI: 10.1051/Jphyscol:1982604  0.456
1981 Balluffi RW, Bristowe PD, Sun CP. Structure Of High-Angle Grain-Boundaries In Metals And Ceramic Oxides Journal of the American Ceramic Society. 64: 23-34. DOI: 10.1111/J.1151-2916.1981.Tb09553.X  0.436
1981 Kwok T, Ho PS, Yip S, Balluffi RW, Bristowe PD, Brokman A. Evidence for vacancy mechanism in grain boundary diffusion in bcc iron: A molecular-dynamics study Physical Review Letters. 47: 1148-1151. DOI: 10.1103/Physrevlett.47.1148  0.634
1981 Brokman A, Bristowe PD, Balluffi RW. Computer simulation study of the structure of vacancies in grain boundaries Journal of Applied Physics. 52: 6116-6127. DOI: 10.1063/1.328508  0.667
1981 Brokman A, Bristowe PD, Balluffi RW. Atomistic faceting of assymetric tilt boundaries Scripta Metallurgica. 15: 201-206. DOI: 10.1016/0036-9748(81)90329-X  0.621
1981 Balluffi RW, Kwok T, Bristowe PD, Brokman A, Ho PS, Yip S. Determination of vacancy mechanism for grain boundary self-diffusion by computer simulation Scripta Metallurgica. 15: 951-956. DOI: 10.1016/0036-9748(81)90285-4  0.619
1981 Balluffi RW, Bristowe PD, Sun CP. Structure Of High-Angle Grain Boundaries In Metals And Ceramic Oxides Cheminform. 12. DOI: 10.1002/Chin.198122352  0.383
1980 Bristowe PD, Brokman A, Spaepen F, Balluffi RW. SIMULATION OF THE STRUCTURE OF VACANCIES IN HIGH ANGLE GRAIN BOUNDARIES Scripta Metallurgica. 14: 943-950. DOI: 10.1016/0036-9748(80)90326-9  0.656
1980 Bristowe PD, Brokman A. On the volume dependence of computed grain boundary energy Scripta Metallurgica. 14: 1129-1133. DOI: 10.1016/0036-9748(80)90219-7  0.364
1980 Bristowe PD, Sass SL. The atomic structure of a large angle [001] twist boundary in gold determined by a joint computer modelling and X-ray diffraction study Acta Metallurgica. 28: 575-588. DOI: 10.1016/0001-6160(80)90124-8  0.429
1978 Bristowe PD, Crocker AG. The structure of high-angle (001) CSL twist boundaries in f.c.c. metals Philosophical Magazine. 38: 487-502. DOI: 10.1080/01418617808239249  0.678
1978 Miller KM, Bristowe PD. COMPUTER SIMULATION OF POINT DEFECTS AND PLANAR DEFECTS IN NICKEL Physica Status Solidi (B) Basic Research. 86: 93-102. DOI: 10.1002/Pssb.2220860110  0.335
1977 Bristowe PD, Crocker AG. A computer simulation study of the structure of twinning dislocations in body centred cubic metals Acta Metallurgica. 25: 1363-1371. DOI: 10.1016/0001-6160(77)90112-2  0.434
1976 Bristowe PD, Crocker AG. Zonal twinning dislocations in body centred cubic crystals Philosophical Magazine. 33: 357-362. DOI: 10.1080/00318087608225780  0.641
1975 Bristowe PD, Crocker AG. A computer simulation study of the structures of twin boundaries in body-centred cubic crystals Philosophical Magazine. 31: 503-517. DOI: 10.1080/14786437508226533  0.409
1974 Crocker EG, Bristowe PD. On symmetric variations of fault energies Acta Crystallographica Section A. 30: 855-856. DOI: 10.1107/S0567739474002038  0.329
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