News
June 24, 2021
New tutorials: automatic reaction networks, crystals, surfaces, polymers, ETS-NOCV, polarizable force fields
The Amsterdam Modeling Suite 2021 release also includes a few new tutorials which we hope are useful to get you started:
- Automatic reaction networks (PES exploration)
- Introduction to crystals and surfaces
- Emission profile with vibronic coupling for an OLED emitter
- Relativistic effects for NMR shifts
- Unrestricted fragments for ETS-NOCV analysis
- Closing the band gap of a 2D semiconductor with an electric field
- Polarizable force fields: DIM/QM and QM/FQ
- Polymer mechanical properties: