AMS Newsletter: December 2022
- New tutorials
- Work functions of surfaces and interfaces
- Chemical vapor deposition / Atomic layer deposition with ReaxFF
- Thermal transport with non-equilibrium MD
- Beyond continuum solvation with 3D-RISM
- Tip of the week and webinar videos
- Tip: Work functions of surfaces and interfaces
- Tip: Faster vibrational spectra with mode refinement
- Scalable qsGW and BSE with ADF
- PolTDDFT: excitation spectra of large systems
- r2SCAN-3c(STO) a reliable composite method
- Ligand-field DFT for coordination chemistry
- Recent papers using the Amsterdam Modeling Suite
- COSMO-RS: solvent selection for CO2 capture
- Large-scale self-consistent GS-BWE with ADF
- Ultralight aerogels from proteins with ReaxFF
- Finding the best structure with MS & DFT
- Thermal management: conductivity of COFs