Temperature dependence of the C 13 hyperfine structure of the negatively charged nitrogen-vacancy center in diamond

Abstract

The nitrogen-vacancy (NV) center is a well utilized system for quantum technology, in particular quantum sensing and microscopy. Fully employing the NV center's capabilities for metrology requires a strong understanding of the behavior of the NV center with respect to changing temperature. Here, we probe the NV electronic spin density as the surrounding crystal temperature changes from 10 K to 700 K by examining the hyperfine interactions with a nearest-neighbor 13C. These results are corroborated with ab initio calculations and demonstrate that the change in hyperfine interaction is small and dominated by a change in the hybridization of the orbitals constituting the spin density, thus indicating that the defect and local crystal geometry is returning towards an undistorted structure at higher temperature.