Publikasjoner
- Evaluation of Density Functionals for Si–O–C–H Molecule Thermochemistry
- CO2 Utilization through Reaction with Alcohols: A Quantum Chemical Study
- Formation of dimethyldichlorosilane (M2) in the Müller-Rochow process at the molecular level Les publikasjonen
- Materials science and ontologies Les publikasjonen
- Role of Copper in the formation of Carbon during Direct synthesis of Methylchlorosilanes
- Toward Understanding the Formation of Coke during the MCS Reaction: A Theoretical Approach
- Toward a Unified Description of Battery Data Les publikasjonen
- Reactivity of HCl at the Si(100)-c(4x2) reconstructed surface: a DFT study.
- Structure, hydration, and chloride ingress in C-S-H: Insight from DFT calculations Les publikasjonen
- Documentation on “Design and Implementation of metadata schema for syntactic and semantic interoperability”
Annen formidling
- Going digital to boost safe and sustainable materials innovation markets. The digital safe-and-sustainability-by-design innovation approach of the PINK project
- Workshop on Interfacial Properties: Open Questions (IPOQ)
- Semantic data documentation for FAIR data
- CO2 Utilization Through Reaction with Alcohols: A Computational Mechanistic Study.
- Possible mechanisms for organic carbonates from CO2 capture.
- Creating a platform to investigate a dynamic semi-catalyst
- Digital representation of physical metallurgical knowledge
- Modular workflow components by FAIR input and output
- CHADA template for scanning electron microscopy and how to represent it in the knowledge base
- Materials characterization - Terminology and structured documentation