Blar i SINTEF Open på forfatter "Swang, Ole"
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Structure, hydration, and chloride ingress in C-S-H: Insight from DFT calculations
Svenum, Ingeborg-Helene; Ringdalen, Inga Gudem; Bleken, Francesca Lønstad; Friis, Jesper; Hoche, Daniel; Swang, Ole (Peer reviewed; Journal article, 2020)The structure of Calcium-Silicate-Hydrate (C-S-H) and the effect of variations in its water content have been investigated using density functional theory (DFT) calculations. Trends for calculated densities as a function ... -
Surface Reconstruction, Hydration, and Adhesion of Epoxy to the (0001) Surface of α-Berlinite: Insights from Density Functional Theory Calculations
Sagvolden, Espen; Sunding, Martin Fleissner; Swang, Ole (Peer reviewed; Journal article, 2020)Phosphoric acid anodization (PAA) is a candidate for replacement of toxic chromates during the surface treatment of aluminum prior to gluing in the aerospace industry. During PAA, a layer of AlPO4 forms on top of the alumina ... -
Unimolecular Decomposition Reactions of Picric Acid and its Methylated Derivatives — A DFT Study
Wiik, Kristine; Høyvik, Ida-Marie; Unneberg, Erik; Jensen, Tomas Lunde; Swang, Ole (Peer reviewed; Journal article, 2022)To handle energetic materials safely, it is important to have knowledge about their sensitivity. Density functional theory (DFT) has proven a valuable tool in the study of energetic materials, and in the current work, DFT ...