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J
John A. Purton
swiss federal institutes of technology domain
33
H指数
121
论文数
3.0K
被引数
0
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32
发表时间
发表时间
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被引数
Grain-boundary-dependent segregation and phase separation in ceria-zirconia from atomistic simulation
来自原子模拟的氧化铈-氧化锆中晶界相关的偏析和相分离
ACTA MATERIALIA
IF
9.3
2024-06-01
0
OA
AI
Underwood, Tom L.; Vigorito, Susanna; Molinari, Marco; Purton, John; Wilding, Nigel B.; Irvine, John T. S.; Parker, Stephen C.
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Adaptive kinetic Monte Carlo analysis of healing mechanisms in radiation damaged pyrochlore Gd2Ti2O7.
ACTA MATERIALIA
IF
9.3
2024-04-01
0
OA
AI
Purton, John A.; Hull, Stephen; Teobaldi, Gilberto
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Kinetic Monte Carlo modeling of oxide thin film growth
氧化物薄膜生长的动力学蒙特卡罗模拟
JOURNAL OF CHEMICAL PHYSICS
IF
3.1
2022-06-02
3
OA
AI
Purton, John A.; Elena, Alin M.; Teobaldi, Gilberto
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Oxygen diffusion at the {111} and {110} surfaces of yttrium doped ceria.
SOLID STATE IONICS
IF
3.3
2022-01-01
2
PRE
AI
Purton, J. A.
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Elucidating the nature of grain boundary resistance in lithium lanthanum titanate
阐明钛酸镧锂中晶界电阻的性质
JOURNAL OF MATERIALS CHEMISTRY A
IF
9.5
2021-01-01
49
OA
AI
Symington, Adam R.; Molinari, Marco; Dawson, James A.; Statham, Joel M.; Purton, John; Canepa, Pieremanuele; Parker, Stephen C.
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Quantifying the impact of disorder on Li-ion and Na-ion transport in perovskite titanate solid electrolytes for solid-state batteries
JOURNAL OF MATERIALS CHEMISTRY A
IF
9.5
2020-01-01
19
OA
AI
Symington, Adam R.; Purton, John; Statham, Joel; Molinari, Marco; Islam, M. Saiful; Parker, Stephen C.
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Monte Carlo simulations of gadolinium doped ceria surfaces
SOLID STATE IONICS
IF
3.3
2018-10-01
10
OA
AI
Gunn, David S. D.; Purton, John A.; Metz, Sebastian
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Simulations of doped CeO2 at finite dopant concentrations
SOLID STATE IONICS
IF
3.3
2017-01-01
19
OA
AI
Purton, John A.; Allan, Neil L.; Gunn, David S. D.
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Growth of nano-domains in Gd-CeO2 mixtures: hybrid Monte Carlo simulations
JOURNAL OF MATERIALS CHEMISTRY A
IF
9.5
2016-01-01
21
OA
AI
Purton, John A.; Archer, Adam; Allan, Neil L.; Gunn, David S. D.
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Multi-million atom Monte Carlo simulation of oxide materials and solid solutions
COMPUTATIONAL MATERIALS SCIENCE
IF
3.3
2015-06-01
4
OA
AI
Purton, John A.; Allan, Neil L.
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Adaptive kinetic Monte Carlo simulation of solid oxide fuel cell components
JOURNAL OF MATERIALS CHEMISTRY A
IF
9.5
2014-01-01
18
OA
AI
Gunn, David S. D.; Allan, Neil L.; Purton, John A.
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Guest-Adaptable and Water-Stable Peptide-Based Porous Materials by Imidazolate Side Chain Control
咪唑侧链控制的客体适应性和水稳定性肽基多孔材料
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF
16.9
2013-12-02
105
OA
AI
Katsoulidis, Alexandros P.; Park, Kyo Sung; Antypov, Dmytro; Marti-Gastaldo, Carlos; Miller, Gary J.; Warren, John E.; Robertson, Craig M.; Blanc, Frederic; Darling, George R.; Berry, Neil G.; Purton, John A.; Adams, Dave J.; Rosseinsky, Matthew J.
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Simulation of the Adsorption and Transport of CO2 on Faujasite Surfaces
JOURNAL OF PHYSICAL CHEMISTRY C
IF
3.2
2013-10-15
23
PRE
AI
Crabtree, Jennifer C.; Molinari, Marco; Parker, Stephen C.; Purton, John A.
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Pre-edges in oxygen (1s) x-ray absorption spectra: A spectral indicator for electron hole depletion and transport blocking in iron perovskites
APPLIED PHYSICS LETTERS
IF
3.6
2009-05-19
39
OA
AI
Braun, Artur; Bayraktar, Defne; Erat, Selma; Harvey, Ashley S.; Beckel, Daniel; Purton, John A.; Holtappels, Peter; Gauckler, Ludwig J.; Graule, Thomas
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He incorporation and diffusion pathways in pure and defective zircon ZrSiO4: A density functional theory study
CHEMICAL GEOLOGY
IF
3.6
2009-01-01
60
PRE
AI
Saadoune, Iman; Purton, John A.; de Leeuw, Nora H.
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Redox behavior of the model catalyst Pd/CeO2-x/Pt(111)
JOURNAL OF PHYSICAL CHEMISTRY C
IF
3.2
2008-06-26
67
PRE
AI
Wilson, E. L.; Grau-Crespo, R.; Pang, C. L.; Cabailh, G.; Chen, Q.; Purton, J. A.; Catlow, C. R. A.; Brown, W. A.; de Leeuw, N. H.; Thornton, G.
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Use of massively parallel molecular dynamics simulations for radiation damage in pyrochlores
JOURNAL OF MATERIALS SCIENCE
IF
3.9
2007-01-25
18
OA
AI
Todorov, Ilian T.; Allan, Neil L.; Purton, J. A.; Dove, Martin T.; Smith, William
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Atomistic simulations of surface diffusion and segregation in ceramics
COMPUTATIONAL MATERIALS SCIENCE
IF
3.3
2006-05-01
9
PRE
AI
Lavrentiev, MY; Allan, NL; Harding, JH; Harris, DJ; Purton, JA
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Beyond the point defect limit: Simulation methods for solid solutions and highly disordered systems
COMPUTATIONAL MATERIALS SCIENCE
IF
3.3
2006-05-01
6
OA
AI
Allan, NL; Barrera, GD; Lavrentiev, MY; Freeman, CL; Todorov, IT; Purton, JA
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Simulation of thermodynamic mixing properties of garnet solid solutions at high temperatures and pressures
CHEMICAL GEOLOGY
IF
3.6
2006-01-01
19
PRE
AI
Lavrentiev, MY; van Westrenen, W; Allan, NL; Freeman, CL; Purton, JA
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