36 citations · 36 across the 1 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2021
Linker Functionalization in MIL-47(V)-R Metal-Organic Frameworks: Understanding the Electronic Structure
Danny E. P. Vanpoucke
Metal-Organic Frameworks (MOFs) have gained much interest due to their intrinsic tunable nature. In this work, we study how linker functionalization modifies the electronic structu…
cond-mat.mtrl-sci2020
Fingerprinting defects in diamond: Partitioning the vibrational spectrum
Danny E. P. Vanpoucke
In this work, we present a computational scheme for isolating the vibrational spectrum of a defect in a solid. By quantifying the defect character of the atom-projected vibrational…
cond-mat.mtrl-sci2019★ 36 cited
Can Europium Atoms form Luminescent Centres in Diamond: A combined Theoretical-Experimental Study
Danny E. P. Vanpoucke, Shannon S. Nicley, Jorne Raymakers +2
The incorporation of Eu into the diamond lattice is investigated in a combined theoretical-experimental study. The large size of the Eu ion induces a strain on the host lattice, wh…