• About MaX
  • Goals
  • Organisation
  • MaX in a nutshell
  • People at MaX
  • Codes at MaX
  • Project Repository
  • Publications
  • Job openings
  • Newsletter
  • Communication
  • News & Events
  • MaX 2018-2021
• Software
  • Codes
  • Features and algorithms
  • Libraries
  • Workflows
• Exascale
  • Deployments
  • Programming models
  • Co-design
  • Performances
  • Separation of concerns
• Data
  • Fact & Figures
• Services
  • MaX Container technology for HPC system
  • MaX Help Desk
  • MaX High level consultancy
  • Simulations on premises and in the cloud
  • Turn-key materials solutions
  • Services to the Industry
  • Facts & Figures
  • FAQ
• Training
  • Training materials
    • Open Online courses and videolectures
    • Presentations
    • Training material related to the MaX flagship codes
  • List of workshops & schools
  • Training through research in the MaX labs
  • Fact & Figures
• Contact us

QUANTUM ESPRESSO: One Further Step toward the Exascale

Home / QUANTUM ESPRESSO: One Further Step toward the Exascale

I. Carnimeo, F. Affinito, S. Baroni, O. Baseggio, L. Bellentani, R. Bertossa, P. D. Delugas, F. Ferrari Ruffino, S. Orlandini, F. Spiga, and P. Giannozzi

htDOI: 10.1021/acs.jctc.3c00249

https://doi.org/10.1021/acs.jctc.3c00249

https://pubs.acs.org/doi/epdf/10.1021/acs.jctc.3c00249

• 2023

Publications J. Chem. Theory Comput. (2023)