Nordlund, K., Lehtola, S., & Hobler, G. (2025). Erratum: Repulsive interatomic potentials calculated at three levels of theory [Phys. Rev. A 111, 032818 (2025)]. Physical Review A, 112(5), Article 059901. https://doi.org/10.1103/cdrk-x7my
Interatomic potentials; Density Functional Theory (DFT); Quantum chemistry calculation; ion implantation
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Abstract:
In this erratum, we provide new parameters for the Na-O screening function that had an unphysical value at the limit of infinite distance in the original data set.