35 citations · 42 across the 5 of their papers we have counts for
5 papers
Charge state equilibration of nitrogen-vacancy center ensembles in diamond: The role of electron tunneling
Audrius Alkauskas, Chris G. Van de Walle, Lukas Razinkovas +1
The charge state stability of nitrogen-vacancy (NV) centers critically affects their application as quantum sensors and qubits. Understanding charge state conversion and equilibrat…
Resonant states and nuclear dynamics in solid-state systems: the case of silicon-hydrogen bond dissociation
Woncheol Lee, Mark E. Turiansky, Dominic Waldhör +3
Bond breaking in the presence of highly energetic carriers is central to many important phenomena in physics and chemistry, including radiation damage, hot-carrier degradation, act…
Heterostructure Engineering for Wurtzite LaN
Andrew J. E. Rowberg, Sai Mu, Chris G. Van de Walle
Wurtzite LaN (wz-LaN) is a semiconducting nitride with favorable piezoelectric and ferroelectric properties, making it promising for applications in electronics. We use first-princ…
First-principles study of electron transport in ScN
Sai Mu, Andrew J. E. Rowberg, Joshua Leveillee +2
We investigate the conduction-band structure and electron mobility in rocksalt ScN based on density functional theory. The first-principles band structure allows us to obtain band…
SrIrOF: Topochemical conversion of a relativistic Mott state into a spin-orbit driven band insulator
Christi Peterson, Michael W. Swift, Zach Porter +9
The topochemical transformation of single crystals of SrIrO into SrIrOF is reported via fluorine insertion. Characterization of the newly formed SrI…