prof dario alfe
Research
Themes
Contacts
- Prof
- Dario
- Alfe
- Prof Dario Alfe
- Tel: 32361
- Ex: 32361
- d.alfe@ucl.ac.uk
- Website
- https://iris.ucl.ac.uk/iris/extResource/image/01/DALFE65
- 1998-08-01
Address
- 4488
- 01.4, Kathleen Lonsdale Building
- UCL Earth Sciences
- Gower Street
- London
- WC1E 6BT
Appointment
- ACAPRO
- 2006-04-01
- 1
- Professor of Physics
- MF
- Dept of Earth Sciences
- MPS
- Faculty of Maths & Physical Sciences
Joined UCL
- 1998-08-01
Research Summary
Materials modelling with various first principles techniques, including density functional theory and quantum Monte Carlo. Material properties under high pressure and high temperature. Interactions between molecules and surfaces. Metal hydrides.
1 - 10 of 166 Publications
First-principles energetics of water: a many-body analysis
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Non-adiabatic ab initio molecular dynamics of supersonic beam epitaxy of silicon carbide at room temperature
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First-principles modeling of non-covalent interactions in supramolecular systems: The role of many-body effects
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Transport properties for liquid silicon-oxygen-iron mixtures at Earth's core conditions
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Assessment of density functional theory for iron(II) molecules across the spin-crossover transition
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Additional Information
- CMR
