Mohammad-Attrash/NV_nonlinear_DFT: DFT inputs for field-dependent nonlinear polarization of NV centers

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Authors: Mohammad-Attrash
Cited by: 0

Abstract

This release contains the DFT input files and post-processing scripts used to extract the second-order nonlinear susceptibility from field-dependent Berry-phase polarization calculations of NV centers.

Fields of Study & Subjects

Diamond and Carbon-based Materials Research Nonlinear Optical Materials Research Advanced Chemical Physics Studies

Publication details

Journal / source
Zenodo (CERN European Organization for Nuclear Research)
Publication date
27 January 2026