검색결과 : 9건
| No. | Article |
|---|---|
| 1 |
Monte Carlo simulations of gadolinium doped ceria surfaces Gunn DSD, Purton JA, Metz S Solid State Ionics, 324, 128, 2018 |
| 2 |
Simulations of doped CeO2 at finite dopant concentrations Purton JA, Allan NL, Gunn DSD Solid State Ionics, 299, 32, 2017 |
| 3 |
Use of massively parallel molecular dynamics simulations for radiation damage in pyrochlores Todorov IT, Allan NL, Purton JA, Dove MT, Smith W Journal of Materials Science, 42(6), 1920, 2007 |
| 4 |
Monte Carlo simulation of GaN/AlN and AlN/InN mixtures Purton JA, Lavrentiev MY, Allan NL Materials Chemistry and Physics, 105(2-3), 179, 2007 |
| 5 |
Monte Carlo simulation of segregation in ceramic thin films: Comparison of the MgO/MnO {100} and {210} surfaces Purton JA, Allan NL Journal of Crystal Growth, 294(1), 130, 2006 |
| 6 |
Iron wheels on silicon: Wetting behavior and electronic structure of adsorbed organostannoxane clusters Frehill F, Schulte KHG, Martin CP, Wang L, Patel S, Purton JA, Vos JG, Moriarty P Langmuir, 20(15), 6421, 2004 |
| 7 |
Ab initio calculation of phase diagrams of oxides Lavrentiev MY, Allan NL, Barrera GD, Purton JA Journal of Physical Chemistry B, 105(17), 3594, 2001 |
| 8 |
Comparison of atomistic simulations and pseudopotential calculations of the MgO{100}/Ag{100} and MgO{110}/Ag{110} interfaces Purton JA, Bird DM, Parker SC, Bullett DW Journal of Chemical Physics, 110(16), 8090, 1999 |
| 9 |
Monte Carlo and hybrid Monte Carlo molecular dynamics approaches to order-disorder in alloys, oxides, and silicates Purton JA, Barrera GD, Allan NL, Blundy JD Journal of Physical Chemistry B, 102(26), 5202, 1998 |