Posts tagged “experiment”

The strange behaviour of bismuth on Si(001)

July 30, 2013 . DFT .
The structure of a Bi-induced feature on silicon and how it was found
experiment Comparison

Speeds and rates relative to experiment

July 17, 2013 . techniques .
How close can we get to experimental speeds or rates in modelling ?
parameters Comparison MD experiment

Water interactions with carbon nanotubes

July 4, 2013 . Techniques .
Looking at comparison between experiment and modelling in the context of water interaction with carbon nanotubes
comparison experiment water nanotubes testing

Large defects in silicon

April 26, 2013 . techniques .
Analysing large defect structures in silicon from TEM and forcefield-based MD
Comparison experiment MD

What should you do if DFT gets the order wrong ?

April 8, 2013 . DFT .

parameters experiment Comparison