Machine learned Force-Fields for an ab-initio Quality Description of Metal-Organic Frameworks

Documenti analoghi

• Analyzing Heat Transport in Crystalline Polymers in Real and Reciprocal Space
  di: Reicht, Lukas, et al.
  Pubblicazione: (2025)
• Heat transport in crystalline organic semiconductors: coexistence of phonon propagation and tunneling
  di: Legenstein, Lukas, et al.
  Pubblicazione: (2024)
• Electrostatically Designing Materials and Interfaces
  di: Egbert Zojer
  Pubblicazione: (2024)
• Combining Brillouin spectroscopy and machine learned interatomic potentials to probe mechanical properties of metal organic frameworks
  di: Lindner, Florian P., et al.
  Pubblicazione: (2024)
• Ab-initio heat transport in defect-laden quasi-1D systems from a symmetry-adapted perspective
  di: Cen, Yu-Jie, et al.
  Pubblicazione: (2025)