dielectric function calculation
Fernan Saiz
fsai... at gmail.com
Sat Apr 15 10:06:04 UTC 2017
Hello all,
I would like to ask if CP2k is able to calculate the high-frequency
dielectric function epsilon(z) as a function of a given direction z as
formulated by Fu. et al. PRB 57, 6967 (1998). As a further reference, the
all-electron code CRYSTAL14 has it implemented using a finite field
perturbation method.
Thanks,
- Fernan Saiz, PhD
Department of Chemistry
Imperial College London
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