GW100: Benchmarking G0W0 for Molecular Systems

Thumbnail Image

Access rights

openAccess
publishedVersion

URL

Journal Title

Journal ISSN

Volume Title

A1 Alkuperäisartikkeli tieteellisessä aikakauslehdessä
This publication is imported from Aalto University research portal.
View publication in the Research portal (opens in new window)
View/Open full text file from the Research portal (opens in new window)

Authors

Date

2015

Department

Department of Applied Physics

Major/Subject

Mcode

Degree programme

Language

en

Pages

Series

Journal of Chemical Theory and Computation, Volume 11, pp. 5665-5687

Description

Keywords

benchmark set, excited states, GW method, molecules, quantum chemistry

Other note

DOI

10.1021/acs.jctc.5b00453

Citation

van Setten, M J, Caruso, F, Sharifzadeh, S, Ren, X, Scheffler, M, Liu, F, Lischner, J, Lin, L, Deslippe, J R, Louie, S G, Yang, C, Weigend, F, Neaton, J B, Evers, F & Rinke, P 2015, 'GW100: Benchmarking G0W0 for Molecular Systems', Journal of Chemical Theory and Computation, vol. 11, pp. 5665-5687. https://doi.org/10.1021/acs.jctc.5b00453

Permanent link to this item

https://urn.fi/URN:NBN:fi:aalto-202105126715

Collections

[article-cris] Perustieteiden korkeakoulu / SCI