Data supporting "Accurate Total Energies from the Adiabatic-Connection Fluctuation-Dissipation Theorem"
Repository URI
Repository DOI
Change log
Authors
Woods, Nicholas
Godby, Rex
Entwistle, Mike
Description
This is data associated with the publication "Accurate Total Energies from the Adiabatic-Connection Fluctuation-Dissipation Theorem". Four systems are studied, each of which are detailed in the main paper. The code used to generate all the data is contained in the head directory.
Version
Software / Usage instructions
See README inside directory.
Keywords
Density Functional Theory, Numerical Analysis, Linear Response
Publisher
Sponsorship
EPSRC (1819412)