103 citations · 303 across the 6 of their papers we have counts for
8 papers
Phase behaviour of coarse-grained fluids
Vlad P Sokhan, Michael A Seaton, Ilian T Todorov
Soft condensed matter structures often challenge us with complex many-body phenomena governed by collective modes spanning wide spatial and temporal domains. In order to successful…
Semantic interoperability based on the European Materials and Modelling Ontology and its ontological paradigm: Mereosemiotics
Martin Thomas Horsch, Silvia Chiacchiera, Björn Schembera +2
The European Materials and Modelling Ontology (EMMO) has recently been advanced in the computational molecular engineering and multiscale modelling communities as a top-level ontol…
Ontologies for the Virtual Materials Marketplace
Martin Thomas Horsch, Silvia Chiacchiera, Michael A. Seaton +13
The Virtual Materials Marketplace (VIMMP) project, which develops an open platform for providing and accessing services related to materials modelling, is presented with a focus on…
Semantic interoperability and characterization of data provenance in computational molecular engineering
M. T. Horsch, C. Niethammer, G. Boccardo +11
By introducing a common representational system for metadata that describe the employed simulation workflows, diverse sources of data and platforms in computational molecular engin…
Electronic effects in high-energy radiation damage in tungsten
Eva Zarkadoula, Dorothy M. Duffy, Kai Nordlund +4
Although the effects of the electronic excitations during high-energy radiation damage processes are not currently understood, it is shown that their role in the interaction of rad…
Electronic effects in high-energy radiation damage in iron
Eva Zarkadoula, Szymon Daraszewicz, Dorothy M. Duffy +5
Electronic effects are believed to be important in high--energy radiation damage processes where high electronic temperature is expected, yet their effects are not currently unders…
High-energy radiation damage in zirconia: modeling results
Eva Zarkadoula, Ram Devanathan, William J. Weber +5
Zirconia is viewed as a material of exceptional resistance to amorphization by radiation damage, and consequently proposed as a candidate to immobilize nuclear waste and serve as a…
The nature of high-energy radiation damage in iron: Modeling results
Eva Zarkadoula, Martin T. Dove, Szymon L. Daraszewicz +5
Understanding and predicting a material's performance in response to high-energy radiation damage, as well as designing future materials to be used in intense radiation environment…