GPU acceleration of plane-wave density functional theory calculations in Abinit

Documenti analoghi

• Abinit 2025: New Capabilities for the Predictive Modeling of Solids and Nanomaterials
  di: Verstraete, Matthieu J., et al.
  Pubblicazione: (2025)
• An alternative GPU acceleration for a pseudopotential plane-waves density functional theory code with applications to metallic systems
  di: Gong, Xuejun, et al.
  Pubblicazione: (2024)
• Edge modes for flexural waves in quasi-periodic linear arrays of scatterers
  di: Martí-Sabaté, Marc, et al.
  Pubblicazione: (2021)
• GPU acceleration of hybrid functional calculations in the SPARC electronic structure code
  di: Jing, Xin, et al.
  Pubblicazione: (2025)
• Automated optimization of convergence parameters in plane wave density functional theory calculations via a tensor decomposition-based uncertainty quantification
  di: Janssen, Jan, et al.
  Pubblicazione: (2021)