Researchers from the Skoltech Materials Center have proposed a new approach to modeling the mechanical properties of ...

Density functional theory (DFT) calculations have become a ubiquitous feature of journal articles in all of chemistry’s subdisciplines, used by researchers to electronically characterize molecules or ...

Researchers from the Skoltech Materials Center (part of the VEB.RF Group) have proposed a new approach to modelling the mechanical properties of heterogeneous materials, combining machine learning ...

My group started working on hybrid DFT three years ago when we began our collaboration with the Park group, with whom we were trying to understand the properties of conducting metal-organic frameworks ...

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