Published articles and brochure

AMS Literature

The two main reference papers of AMS are

  1. Chemistry with ADF (2001) | Google Scholar Citations
  2. The Amsterdam Modeling Suite (2025) | Google Scholar Citations

Browse the selection of highlighted peer-review papers below to see how researchers use AMS.

Cosmo rs solvent screening website
Highlights
COSMO-RS thermodynamics

Harnessing COSMO-RS for Sustainable Innovation: From High-Throughput Solvent Screening to Smart Adsorbent Design

Lak functional literature highlight
Highlights
BAND DFT materials science periodic DFT semiconductors

Accurate Binding and Band Gaps at low computational cost with a non-empirical Meta-GGA

Pt nmr adf2025
Highlights
ADF catalysis inorganic chemistry NMR Relativistic DFT spectroscopy

Coordination of Pt Single-Atom Catalysts via NMR: Experiment and Theory

Toc
Highlights
materials science MD polymers ReaxFF

Accelerated ReaxFF Simulations of Vitrimers with Dynamic Covalent Adaptive Networks

Image1
Highlights
BAND periodic DFT perovskite semiconductors spectroscopy

Theoretical calculations reveal origin of violet-blue emission in semiconducting 2D hybrid perovskite

Actinide m4 edge satelites
Highlights
ADF bonding analysis heavy elements inorganic chemistry spectroscopy

Innovative X-ray technique, supported by theoretical calculations, sheds light on actinide bonding properties.

Ln2+complexes configurations
Highlights
ADF bonding analysis heavy elements

Unraveling the interplay of 4fn+1 and 4fn5d1 configurations in Ln2+ complexes

Iron in cross coupling reactions
Highlights
ADF bonding analysis catalysis Reactivity

Can iron mimic the behavior of palladium in cross-coupling reactions?

Recycling 6ppd
Highlights
COSMO-RS materials science solvation

Upcycling 6PPD from tire waste

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