Assessment of density functional theory for iron(II) molecules across the spin-crossover transition. (2012)
Attributed to:
Quantum Monte Carlo simulations on ten thousand to a million cores
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1063/1.4752411
PubMed Identifier: 23020327
Publication URI: http://europepmc.org/abstract/MED/23020327
Type: Journal Article/Review
Volume: 137
Parent Publication: The Journal of chemical physics
Issue: 12
ISSN: 0021-9606