Allbwn ymchwil

Allbwn Ymchwil fesul blwyddyn 1998 2004 2005 2006 2009 2011 2013

• 21 Erthygl
• 7 Papur
• 1 Trafodion Cynhadledd (Nid-Cyfnodolyn fathau)
• 1 Crynodeb
• 3 Mwy
  • 1 Poster
  • 1 Sylwadau/Trafodaethau
  • 1 Llythyr

Allbwn Ymchwil fesul blwyddyn

Allbwn Ymchwil fesul blwyddyn

Canlyniadau chwilio

• 2013

  Hydroxylation of silica nanoclusters (SiO2)M(H2O)N, M = 4, 8, 16, 24: stability and structural trends

  Jelfs, K. E., Flikkema, E. & Bromley, S. T., 2013, Yn: Physical Chemistry Chemical Physics. 15, 47, t. 20438-20443

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Hydroxylation 100%
  • Particle Size 50%
  • Group 33%
  • Water Type 33%
  • Molecule 33%
  17 Dyfyniadau (Scopus)
• 2012

  Evidence for Atomic Mixing via Multiple Intermediates during the Dynamic Interconversion of Silicate Oligomers in Solution

  Jelfs, K. E., Flikkema, E. & Bromley, S. T., 2012, Yn: Chemical Communications. 48, 1, t. 46-48 3 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  Mynediad agored

  Ffeil

  • Silicate 100%
  • Solution 66%
  • Optimization 33%
  • Mixing 33%
  • Species 33%
  14 Dyfyniadau (Scopus)

  200 Wedi eu Llwytho i Lawr (Pure)

• Structure and energetics of hydroxylated silica clusters, (SiO2)M(H2O)N, M=8,16 and N=1-4: A global optimisation study

  Flikkema, E., Jelfs, K. E. & Bromley, S. T., 03 Rhag 2012, Yn: Chemical Physics Letters. 554, t. 117-122 6 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  Mynediad agored

  Ffeil

  • Hydroxylation 100%
  • Energetics 75%
  • Optimization 50%
  • Chemical Reaction 50%
  • Energy 50%
  10 Dyfyniadau (Scopus)

  184 Wedi eu Llwytho i Lawr (Pure)
• 2011

  Global Optimization of (hydroxylated) Silica Clusters

  Flikkema, E. & Bromley, S., 30 Meh 2011.

  Allbwn ymchwil: Cyfraniad at gynhadledd › Papur

• Molecular Dynamics Study of Ion Diffusion in Glassy Materials

  Flikkema, E., Greaves, N. & Zhou, Z., 30 Meh 2011.

  Allbwn ymchwil: Cyfraniad at gynhadledd › Papur

• Using visualisation techniques and Molecular Dynamics to study atoms diffusing in glass

  Flikkema, E., Zhou, Z. & Greaves, N., 31 Rhag 2011, Eurographics 2011 proceedings. Eurographics, t. 47-48 2 t.

  Allbwn ymchwil: Pennod mewn Llyfr/Adroddiad/Trafodion Cynhadledd › Trafodion Cynhadledd (Nid-Cyfnodolyn fathau)
• 2010

  Computational studies of silicate materials: clusters and bulk

  Flikkema, E., 17 Gorff 2010.

  Allbwn ymchwil: Cyfraniad at gynhadledd › Papur

• The minimal perimeter for N confined deformable bubbles of equal area

  Cox, S. J. & Flikkema, E., 27 Ebr 2010, Yn: Electronic Journal of Combinatorics. 17, 1, 25 t., R45.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  Mynediad agored

  Ffeil

  • Partition 100%
  • Number 33%
  • Hexagon 33%
  • Pentagon 33%
  • Energetics 16%
  11 Dyfyniadau (Scopus)

  107 Wedi eu Llwytho i Lawr (Pure)
• 2009

  Defective to fully coordinated crossover in complex directionally bonded nanoclusters

  Flikkema, E. & Bromley, S. T., 07 Gorff 2009, Yn: Physical Review B. 80, 3, 6 t., 035402.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  Ffeil

  • Nanoclusters 100%
  • Particle Size 37%
  • Energy 37%
  • Structure 37%
  • Nanoscale 25%
  15 Dyfyniadau (Scopus)

  161 Wedi eu Llwytho i Lawr (Pure)

• Energy landscapes and basin sampling of bulk mixed oxide systems

  Flikkema, E. & Wales, D. J., 07 Medi 2009.

  Allbwn ymchwil: Cyfraniad at gynhadledd › Poster

  • Sampling 100%
  • Structural Basin 83%
  • Procedure 83%
  • Lime 66%
  • Magnesium Oxide 66%

• Exploring Low-energy Fully-coordinated (SiO2)N Nano-clusters with Graph-based sampling

  Flikkema, E. & Bromley, S. T., 30 Meh 2009.

  Allbwn ymchwil: Cyfraniad at gynhadledd › Papur

• Graph-based global optimisation of fully-coordinated silica clusters

  Flikkema, E., 05 Gorff 2009.

  Allbwn ymchwil: Cyfraniad at gynhadledd › Crynodeb

  • Geometry 100%
  • Optimization 60%
  • Energy 60%
  • Algorithms 40%
  • Oxygen Atom 40%

• Graph-based global optimization of fully-coordinated cluster geometries

  Flikkema, E. & Bromley, S. T., 17 Maw 2009.

  Allbwn ymchwil: Cyfraniad at gynhadledd › Papur

  • Geometry 100%
  • Optimization 50%
  • Energy 50%
  • Algorithms 33%
  • Oxygen Atom 33%
• 2008

  Energy landscapes and thermodynamics of bulk mixed oxide materials

  Flikkema, E., 23 Gorff 2008.

  Allbwn ymchwil: Cyfraniad at gynhadledd › Papur

  • Sampling 100%
  • Landscape 75%
  • Structural Basin 75%
  • Energy 75%
  • Procedure 75%

• Graph-based sampling of fully-coordinated silica (SiO2)N clusters

  Flikkema, E. & Bromley, S. T., 16 Medi 2008.

  Allbwn ymchwil: Cyfraniad at gynhadledd › Papur

  • Silica 100%
  • Silicon Dioxide 100%
  • Geometry 66%
  • Optimization 50%
  • Monte Carlo 50%
• 2006

  Comparing the influence of framework type on H₂ absorption in hypothetical and existing clathrasils: A grand canonical Monte Carlo study

  Van Den Berg, A. W. C., Zwijnenburg, M. A., Bromley, S. T., Flikkema, E., Bell, R. G., Jansen, J. C. & Schoonman, J., 2006, Yn: Journal of Materials Chemistry. 16, 32, t. 3285-3290 6 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Clathrasils 100%
  • Hydrogen 75%
  • Volume 50%
  • Energy 50%
  • Structure 50%
  6 Dyfyniadau (Scopus)

• Molecular dynamics-based approach to study the anisotropic self-diffusion of molecules in porous materials with multiple cage types: Application to H-2 in losod

  Van den Berg, A. W. C., Flikkema, E., Lems, S., Bromley, S. T. & Jansen, J. C., 09 Rhag 2006, Yn: Journal of Physical Chemistry B. 110, 1, t. 501-506 6 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Diffusivity 100%
  • Hydrogen 37%
  • Membrane 25%
  • Utilization 25%
  • Media 12%
  2 Dyfyniadau (Scopus)

• New materials from fully coordinated SiO₂ nanoclusters

  Bromley, S. T. & Flikkema, E., Maw 2006, Yn: Computational Materials Science. 35, 3, t. 382-386 5 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Nanocrystalline Material 100%
  • Defect 66%
  • Material 66%
  • Nanoclusters 66%
  • Mesoporous Material 33%
  17 Dyfyniadau (Scopus)
• 2005

  Columnar-to-disk structural transition in nanoscale (SiO2)(N) clusters

  Bromley, S. T. & Flikkema, E., 28 Hyd 2005, Yn: Physical Review Letters. 95, 18, 4 t., 185505.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Disk 100%
  • Nanoscale 100%
  • Base 50%
  • Optimization 50%
  • Ab Initio Calculation 50%
  48 Dyfyniadau (Scopus)

• Novel structures and energy spectra of hydroxylated (Si O2) 8 -based clusters: Searching for the magic (Si O2) 8 O2 H3- cluster

  Bromley, S. T. & Flikkema, E., 15 Maw 2005, Yn: Journal of Chemical Physics. 122, 11, 114303.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Ground State 100%
  • Structure 100%
  • Spectra 66%
  • Energy 66%
  • Optimization 33%
  20 Dyfyniadau (Scopus)

• Self-diffusion of molecular hydrogen in clathrasils compared: Dodecasil 3C versus sodalite

  Van Den Berg, A. W. C., Flikkema, E., Jansen, J. C. & Bromley, S. T., 22 Mai 2005, Yn: Journal of Chemical Physics. 122, 20, 204710.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Sodalite 100%
  • Self-Diffusion 66%
  • Hydrogen 66%
  • Clathrasils 33%
  • Rate 16%
  11 Dyfyniadau (Scopus)
• 2004

  Bromley et al. Reply

  Bromley, S. T., Zwijnenburg, M. A., Flikkema, E. & Maschmeyer, T., 2004, Yn: Physical Review Letters. 92, 3, t. 1 1 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Sylwadau/Trafodaethau › adolygiad gan gymheiriaid

• Comment on "Fully Coordinated Silica Nanoclusters: (SiO ₂)_n Molecular Rings" [1] (multiple letters)

  Sun, Q., Wang, Q., Jena, P., Bromley, S. T., Zwijnenburg, M. A., Flikkema, E. & Maschmeyer, T., 23 Ion 2004, Yn: Physical Review Letters. 92, 3, t. 396011+396021

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Llythyr › adolygiad gan gymheiriaid

  17 Dyfyniadau (Scopus)

• Dedicated global optimization search for ground state silica nanoclusters: (SiO2)(N) (N=6-12)

  Flikkema, E. & Bromley, S. T., 19 Meh 2004, Yn: Journal of Physical Chemistry B. 108, 28, t. 9638-9645 8 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Nanoclusters 100%
  • Energy 74%
  • Structure 74%
  • Optimization 50%
  • Block Like Crystal 25%
  87 Dyfyniadau (Scopus)

• Effect of cation distribution on self-diffusion of molecular hydrogen in Na₃Al₃Si₃O₁₂ sodalite: A molecular dynamics study

  Van Den Berg, A. W. C., Bromley, S. T., Flikkema, E. & Jansen, J. C., 22 Tach 2004, Yn: Journal of Chemical Physics. 121, 20, t. 10209-10216 8 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Sodalite 100%
  • Temperature 66%
  • Self-Diffusion 50%
  • Diffusion 33%
  18 Dyfyniadau (Scopus)

• Molecular-dynamics analysis of the diffusion of molecular hydrogen in all-silica sodalite

  Van Den Berg, A. W. C., Bromley, S. T., Flikkema, E., Wojdel, J., Maschmeyer, T. & Jansen, J. C., 01 Meh 2004, Yn: Journal of Chemical Physics. 120, 21, t. 10285-10289 5 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Sodalite 100%
  • Temperature 33%
  • Facilitated Diffusion 16%
  • Diffusivity 16%
  • Energy 16%
  43 Dyfyniadau (Scopus)

• Prospects for a synthetic route towards well-defined stoichiometric silica nanoclusters: From siloxane to silica

  Zwijnenburg, M. A., Bromley, S. T., Flikkema, E. & Maschmeyer, T., 16 Chwef 2004, Yn: Chemical Physics Letters. 385, 5-6, t. 389-393 5 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Nanoclusters 100%
  • Siloxane 41%
  • Defect 8%
  • Chemical Reaction Product 8%
  • Density 8%
  15 Dyfyniadau (Scopus)
• 2003

  A new interatomic potential for nanoscale silica

  Flikkema, E. & Bromley, S. T., 12 Medi 2003, Yn: Chemical Physics Letters. 378, 5-6, t. 622-629 8 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Potential 100%
  • Structure 80%
  • Nanoclusters 60%
  • Interatomic Potential 40%
  • Energy 40%
  102 Dyfyniadau (Scopus)
• 2002

  Influence of rigid side chain attraction on stiffness and conformations of comb copolymer brushes strongly adsorbed on a flat surface

  Flikkema, E. & Ten Brinke, G., 18 Hyd 2002, Yn: Macromolecular Theory and Simulations. 11, 7, t. 777-784 8 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Side Chain 100%
  • Characteristics 20%
  • Polymer Brush 20%
  • Properties 10%
  • Interaction Energy 10%
  7 Dyfyniadau (Scopus)
• 2000

  Osmotic pressure of ring polymer solutions: A Monte Carlo study

  Flikkema, E. & Ten Brinke, G., Rhag 2000, Yn: Journal of Chemical Physics. 113, 24, t. 11393-11395 3 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Rings 100%
  • Polymers 100%
  • Polymer 100%
  • Linear Chain 50%
  • Osmotic Pressure 50%
  7 Dyfyniadau (Scopus)

• Ring comb copolymer brushes

  Flikkema, E., Subbotin, A. & Ten Brinke, G., 01 Tach 2000, Yn: Journal of Chemical Physics. 113, 17, t. 7646-7651 6 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Comb Copolymer 100%
  • Equilibrium 50%
  • Atom 50%
  • Length 50%
  • Radius of Gyration 50%
  5 Dyfyniadau (Scopus)
• 1998

  Flow-induced phase separation in polymer solutions

  De Moel, K., Flikkema, E., Szleifer, I. & Ten Brinke, G., 15 Mai 1998, Yn: Europhysics Letters. 42, 4, t. 407-412 6 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Polymer 100%
  • Flow 42%
  • Thermodynamics 28%
  • Aqueous Solution 28%
  • Phase Behavior 14%
  10 Dyfyniadau (Scopus)

• Temperature modulated calorimetry of glassy polymers and polymer blends

  Flikkema, E., Alberda Van Ekenstein, G. & Ten Brinke, G., 10 Chwef 1998, Yn: Macromolecules. 31, 3, t. 892-898 7 t.

  Allbwn ymchwil: Cyfraniad at gyfnodolyn › Erthygl › adolygiad gan gymheiriaid

  • Differential Scanning Calorimetry 100%
  • Heat 50%
  • Region 50%
  • Relaxation 33%
  • Flow 33%
  11 Dyfyniadau (Scopus)