@article{afb6a8d4e3254bdbbf2bc9e6bc8aa81c,
title = "Electric field gradients at the nuclei from all-electron four-component relativistic density functional theory using Gaussian-type orbitals",
keywords = "116 Chemical sciences, Hartree-fock calculations, Auxiliary basis-sets, Zeta basis-sets, Quadrupole resonance, Structural-characterization, Energy derivatives, Periodic-systems, Triple-zeta, Approximation, Bi-209",
author = "Marc Joosten and Michal Repisky and Marius Kadek and Pekka Pyykko and Kenneth Ruud",
year = "2024",
month = jul,
day = "23",
doi = "10.1103/PhysRevB.110.045141",
language = "English",
volume = "110",
journal = "Physical Review B",
issn = "2469-9950",
publisher = "American Physical Society ",
number = "4",
}