Goedecker-Teter-Hutter (GTH) pseudopotentials
Select an element from the periodic table below to update the pseudopotential file list and click on a file name.
- S. Goedecker, M. Teter, and J. Hutter, Separable dual-space Gaussian pseudopotentials, Phys. Rev. B 54, 1703-1710 (1996)
- C. Hartwigsen, S. Goedecker, and J. Hutter, Relativistic separable dual-space Gaussian pseudopotentials from H to Rn, Phys. Rev. B 58, 3641-3662 (1998)
- M. Krack, Pseudopotentials for H to Kr optimized for gradient-corrected exchange-correlation functionals, Theor. Chem. Acc. 114, 145-152 (2005)
The author does not give any warranty for the correctness or quality of the provided pseudopotentials.