98 citations · 133 across the 3 of their papers we have counts for
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Optimized Gaussian exponents for Goedecker-Teter-Hutter pseudopotentials
Eeuwe S. Zijlstra, Nils Hunteman, Alan Kalitsov +2
We have optimized the exponents of Gaussian s and p basis functions for the elements H, B-F, and Al-Cl using the pseudopotentials of Goedecker, Teter, and Hutter [Phys. Rev. B 54,…
Laser-induced solid-solid phase transition in As under pressure: A theoretical prediction
Eeuwe S. Zijlstra, Nils Huntemann, Martin E. Garcia
In Arsenic a pressure-induced solid-solid phase transition from the A7 into the simple cubic structure has been experimentally demonstrated [Beister et al., Phys. Rev. B 41, 5535 (…
All-electron theory of the coupling between laser-induced coherent phonons in bismuth
Eeuwe S. Zijlstra, Larisa L. Tatarinova, Martin E. Garcia
Using first principles, all-electron calculations and dynamical simulations we study the behavior of the A_1g and E_g coherent phonons induced in Bi by intense laser pulses. We det…
Electronic states in 1/1 Cd6Yb and 1/1 Cd6Ca: Relativistic, correlation, and structural effects
E. S. Zijlstra, S. K. Bose, R. Tamura
The electronic structure of the rational approximants 1/1 Cd6Yb and 1/1 Cd6Ca to the stable icosahedral CdYb and CdCa quasicrystals is studied by the full-potential linear augmente…