We benchmarked our GW implementation against the GW100 data set, comparing the Godby–Needs plasmon-pole model and our Multipole Approximation (MPA). Both perform excellently vs. full-frequency references, with MPA delivering outstanding agreement.
I'm happy to share our latest publication: "Benchmarking the Plasmon-Pole and Multipole Approximations in the Yambo Code Using the GW100 Data Set." Reliable computational methods require rigorous verification and validation. In this work, we benchmark the GW implementation in the Yambo code against the GW100 reference data set. This work contributes to ongoing community efforts toward reproducible and reliable electronic structure simulations. Many thanks to all my co-authors and collaborators who made this research possible! 📄 Read the paper: https://lnkd.in/dPcsnXdV #MaterialsScience #ElectronicStructure #ManyBodyPerturbationTheory #GW #Yambo