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A. Michaelides

4 papers hereh-index 8031.7k citations346 works total

Matching runs newest-first, so older work may not be attached to this profile yet.

author position
  • middle author4

Across the 4 of 4 papers where every author was matched, so the position is known.

fields
  • cond-mat.mtrl-sci4

identity via Semantic Scholar / OpenAlex

activity
20072009
most citedOn the accuracy of DFT exchange-correlation functionals for H bonds in small water clusters II: The water hexamer and van der Waals interactions

239 citations · 658 across the 4 of their papers we have counts for

collaborators
Showing 2007Show all

1 paper · 1 filter

cond-mat.mtrl-sci2007★ 232 cited

On how good DFT exchange-correlation functionals are for H bonds in small water clusters: Benchmarks approaching the complete basis set limit

Biswajit Santra, Angelos Michaelides, Matthias Scheffler

The ability of several density-functional theory (DFT) exchange-correlation functionals to describe hydrogen bonds in small water clusters (dimer to pentamer) in their global minim…

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Not affiliated with arXiv. Researcher data from Semantic Scholar (ODC-BY) and OpenAlex.